2305-31-9 (顺-1,3-环己烷二羧酸,cis-cyclohexane-1,3-dicarboxylic acid)

快速询单

结构式：

顺-1,3-环己烷二羧酸MOL文件

CAS号：

2305-31-9

中文名称：

顺-1,3-环己烷二羧酸

英文名称：

cis-cyclohexane-1,3-dicarboxylic acid

安全信息：

分子式：

C₈H₁₂O₄

分子量：

172.178483009338

顺-1,3-环己烷二羧酸(2305-31-9)名称与标识符

名称

中文别名：

顺-1,3-环己烷二甲酸;顺式-1,3-环己烷二甲酸;cis-1,3-Cyclohexanedicarboxylic Acid 顺-1,3-环己烷二甲酸;顺-1,3-环己烷二羧酸;

英文别名：

1,3-Cyclohexanedicarboxylicacid, (1R,3S)-rel-;cis-1,3-Cyclohexanedicarboxylic Acid;cis-Cyclohexane-1,3-dicarboxylic acid;meso-cis-1,3-cyclohexanedicarboxylic acid;(1R,3S)-cyclohexane-1,3-dicarboxylic acid;1,3-Cyclohexanedicarboxylic acid, (1R,3S)-rel-;8QXE081K9B;1,3-Cyclohexanedicarboxylic acid, cis-;AK164565;cis-1,3-cyclohexanedicarboxylicacid;XBZSBBLNHFMTEB-OLQVQODUSA-N;NE11835;EBD3313760;F;AC1031;AM9669;1,3-CIS-CYCLOHEXANEDICARBOXYLIC ACID;AKOS016017528;EN300-125177;REL-(1R,3S)-1,3-CYCLOHEXANEDICARBOXYLIC ACID;2305-31-9;C2197;(1S,3R)-cyclohexane-1,3-dicarboxylic acid;MFCD01311240;A878343;P18631;cis-Cyclohexane-1,3-dicarboxylicacid;rel-(1R,3S)-Cyclohexane-1,3-dicarboxylic acid;Z1255446499;SCHEMBL2049696;UNII-8QXE081K9B;CS-0047351;Q27895979;CS-12263;

标识符

MDL：

MFCD01311240

InChIKey：

XBZSBBLNHFMTEB-OLQVQODUSA-N

Inchi：

1S/C8H12O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)/t5-,6+

SMILES：

OC([C@@H]1CCC[C@H](C(=O)O)C1)=O

顺-1,3-环己烷二羧酸(2305-31-9)物化性质

实验特性

LogP : 0.96200
PSA : 74.60000
折射率 : 1.521
沸点 : 332.4℃ at 760 mmHg
熔点 : 163.0 to 167.0 deg-C
闪点 : 169°C
颜色与性状 : 未确定
溶解性 : 未确定
密度 : 1.314

计算特性

精确分子量 : 172.07400
氢键供体数量 : 2
氢键受体数量 : 4
可旋转化学键数量 : 2
同位素质量 : 172.074
重原子数量 : 12
复杂度 : 179
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 2
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 0.7
表面电荷 : 0
拓扑分子极性表面积 : 74.6

顺-1,3-环己烷二羧酸(2305-31-9)安全信息

符号： GHS07
危害声明：H315-H319
警示性声明：P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
提示语：警告

顺-1,3-环己烷二羧酸(2305-31-9)海关数据

海关编码：

2917209090

海关数据：

中国海关编码：

2917209090

概述：

HS:2917209090 其他（环烷、环烯、环萜烯）多元羧酸增值税率:17.0% 退税率:9.0% 监管条件:AB(入境货物通关单,出境货物通关单) 最惠国关税:6.5% 普通关税:30.0%

申报要素：

品名, 成分含量, 用途, 对苯二甲酸请注明4-CBA值, 对苯二甲酸请注明P-TL酸值, 对苯二甲酸请注明色度, 对苯二甲酸请注明水分

监管条件：

A.入境货物通关单
B.出境货物通关单

检验检疫类别：

R.进口食品卫生监督检验
S.出口食品卫生监督检验

Summary：

2917209090 other cyclanic, cyclenic or cyclotherpenic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:6.5%。general tariff:30.0%

顺-1,3-环己烷二羧酸(2305-31-9)推荐厂家更多厂家(24)

公司名称	手机号/电话	联系人	QQ	询单
江苏新素新材料有限公司	13914000513 0512-66387919	孙文婷	3771156959	询单
上海源叶生物科技有限公司	15026964105 15026964105	汤思磊	2881489226	询单
上海瀚思化工有限公司	18939883912 021-34536277	顾经理	3003949364	询单
湖北垚烁泉化工有限公司	18971238634	吴经理	2189484023	询单
上海腾准生物科技有限公司	19821570922 021-34053661	张经理	3003871136	询单
北京百灵威科技有限公司	18210857532	翟先生	3650742139	询单
上海绩祥生物科技有限公司	13093077543	陆经理	3985448220	询单
湖北常鑫盛化工有限公司	18971238634	吴经理	2189484023	询单
上海一基实业有限公司	13311756131 021-60548336 QQ：2355265332 QQ:2851717387	胡经理	2355265332	询单
上海一基实业有限公司	13311756052 021-60526763 13311756052 13311756131	胡经理	2355265332	询单

顺-1,3-环己烷二羧酸(2305-31-9)相关文献

1. Nitroaromatic-detecting cadmium cyclohexyldicarboxylate coordination polymers with bis(4-pyridylmethyl)piperazine coligands and unprecedented 2D and 3D topologies
Andrew R. LaDuca,Robert L. LaDuca CrystEngComm 2018 20 5677

顺-1,3-环己烷二羧酸(2305-31-9)参考资料

Reaxys RN：

2049747

Beilstein：

9(4)2805

PubChem CID：

6432255

顺-1,3-环己烷二羧酸(2305-31-9) MSDS

基础信息

Section I.Chemical Product and Company Identification
    Chemical Name cis-1,3-Cyclohexanedicarboxylic Acid
    Portland OR
    Synonym        1,3-Cyclohexanedicarboxylic acid,
    (1R,3S)-rel- (CA INDEX NAME)
    C8H12O4
    Chemical Formula
    CAS Number        2305-31-9

Section II.        Composition and Information on Ingredients
    Chemical Name        CAS Number Percent (%)        TLV/PEL        Toxicology Data
    cis-1,3-Cyclohexanedicarboxylic Acid        2305-31-9        Min. 98.0 Not available.        Not available.
    (GC,T)

Section III. Hazards Identification
    Acute Health Effects        No specific information is available in our data base regarding the toxic effects of this material for humans. However,
    exposure to any chemical should be kept to a minimum. Skin and eye contact may result in irritation. May be harmful if
    inhaled or ingested. Always follow safe industrial hygiene practices and wear proper protective equipment when handling
    this compound.
    Follow safe industrial hygiene practices and always wear proper protective equipment when handling this compound.
    CARCINOGENIC EFFECTS : Not available.
    Chronic Health Effects
    MUTAGENIC EFFECTS : Not available.
    TERATOGENIC EFFECTS : Not available.
    DEVELOPMENTAL TOXICITY: Not available.
    Repeated or prolonged exposure to this compound is not known to aggravate existing medical conditions.

Section IV.        First Aid Measures
    Eye Contact        Check for and remove any contact lenses. In case of contact, immediately flush eyes with plenty of water for at least 15
    minutes. Get medical attention.
    Skin Contact        In case of contact, immediately flush skin with plenty of water. Remove contaminated clothing and shoes. Wash clothing
    before reuse. Thoroughly clean shoes before reuse. Get medical attention.
    Inhalation        If the victim is not breathing, perform mouth-to-mouth resuscitation. Loosen tight clothing such as a collar, tie, belt or
    waistband. If breathing is difficult, oxygen can be administered. Seek medical attention if respiration problems do not
    improve.
    Ingestion        INDUCE VOMITING by sticking finger in throat. Lower the head so that the vomit will not reenter the mouth and throat.
    Loosen tight clothing such as a collar, tie, belt or waistband. If the victim is not breathing, perform mouth-to-mouth
    resuscitation. Examine the lips and mouth to ascertain whether the tissues are damaged, a possible indication that the
    toxic material was ingested; the absence of such signs, however, is not conclusive.

Section V.        Fire and Explosion Data
    Auto-Ignition        Not available.
    Flammability        May be combustible at high temperature.
    Flash Points        Flammable Limits        Not available.
    Not available.
    Combustion Products        These products are toxic carbon oxides (CO, CO 2).
    Fire Hazards
    Not available.
    Risks of explosion of the product in presence of mechanical impact: Not available.
    Explosion Hazards
    Risks of explosion of the product in presence of static discharge: Not available.
    Fire Fighting Media
    SMALL FIRE: Use DRY chemical powder.
    and Instructions        LARGE FIRE: Use water spray, fog or foam. DO NOT use water jet.
    Consult with local fire authorities before attempting large scale fire-fighting operations.
    Continued on Next Page
    cis-1,3-Cyclohexanedicarboxylic Acid

Section VI.        Accidental Release Measures
    Spill Cleanup        Use a shovel to put the material into a convenient waste disposal container. Finish cleaning the spill by rinsing any
    Instructions        contaminated surfaces with copious amounts of water. Consult federal, state, and/or local authorities for assistance on
    disposal.

Section VII. Handling and Storage
    Handling and Storage        Keep away from heat. Mechanical exhaust required. When not in use, tightly seal the container and store in a dry, cool
    place. Avoid excessive heat and light. Do not breathe dust.
    Information
    Always store away from incompatible compounds such as oxidizing agents.

Section VIII. Exposure Controls/Personal Protection
    Engineering Controls        Use process enclosures, local exhaust ventilation, or other engineering controls to keep airborne levels below
    recommended exposure limits. If user operations generate dust, fume or mist, use ventilation to keep exposure to
    airborne contaminants below the exposure limit.
    Personal Protection        Splash goggles. Lab coat. Dust respirator. Boots. Gloves. Suggested protective clothing might not be sufficient; consult
    a specialist BEFORE handling this product. Be sure to use a MSHA/NIOSH approved respirator or equivalent.
    Exposure Limits        Not available.

Section IX. Physical and Chemical Properties
    Solid.        Solubility
    Physical state @ 20°C        Not available.
    Not available.
    Specific Gravity
    Molecular Weight        172.18        Partition Coefficient        Not available.
    Boiling Point
    Not available.        Vapor Pressure        Not applicable.
    Melting Point        165°C (329°F)        Vapor Density        Not available.
    Refractive Index        Not available.        Volatility        Not available.
    Critical Temperature        Not available.        Odor        Not available.
    Viscosity        Not available.        Taste        Not available.

Section X. Stability and Reactivity Data
Stability

This material is stable if stored under proper conditions. (See Section VII for instructions)
    Conditions of Instability        Avoid excessive heat and light.
    Incompatibilities
    Reactive with oxidizing agents.

Section XI. Toxicological Information
    RTECS Number        Not available.
    Eye Contact. Ingestion. Inhalation.
    Routes of Exposure
    Toxicity Data        Not available.
    Chronic Toxic Effects        CARCINOGENIC EFFECTS : Not available.
    MUTAGENIC EFFECTS : Not available.
    TERATOGENIC EFFECTS : Not available.
    DEVELOPMENTAL TOXICITY: Not available.
    Repeated or prolonged exposure to this compound is not known to aggravate existing medical conditions.
    Acute Toxic Effects        No specific information is available in our data base regarding the toxic effects of this material for humans. However,
    exposure to any chemical should be kept to a minimum. Skin and eye contact may result in irritation. May be harmful if
    inhaled or ingested. Always follow safe industrial hygiene practices and wear proper protective equipment when handling
    this compound.
    Follow safe industrial hygiene practices and always wear proper protective equipment when handling this compound.
    Continued on Next Page
    cis-1,3-Cyclohexanedicarboxylic Acid

Section XII.        Ecological Information
    Ecotoxicity        Not available.
    Environmental Fate        Not available.

Section XIII. Disposal Considerations
    Recycle to process, if possible. Consult your local regional authorities. You may be able to dissolve or mix material with a
    Waste Disposal
    combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber system. Observe all
    federal, state and local regulations when disposing of the substance.

Section XIV. Transport Information
    DOT Classification        Not a DOT controlled material (United States).
    PIN Number        Not applicable.
    Proper Shipping Name
    Not applicable.
    Packing Group (PG)        Not applicable.
    DOT Pictograms

Section XV. Other Regulatory Information and Pictograms
    TSCA Chemical Inventory        This product is NOT on the EPA Toxic Substances Control Act (TSCA) inventory. The following notices are required by 40
    CFR 720.36 (C) for those products not on the inventory list:
    (EPA)
    (i) These products are supplied solely for use in research and development by or under the supervision of a technically
    qualified individual as defined in 40 CFR 720.0 et sec.
    (ii) The health risks of these products have not been fully determined. Any information that is or becomes available will be
    supplied on an MSDS sheet.
    WHMIS Classification        Not controlled under WHMIS (Canada).
    (Canada)
    EINECS Number (EEC) Not available.
    EEC Risk Statements        Not available.

SECTION 16 - ADDITIONAL INFORMATION
N/A