52240-19-4 (反式-2-(p-氯苯甲酰基)-1-环己烷羧酸,trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid)

快速询单

结构式：

反式-2-(p-氯苯甲酰基)-1-环己烷羧酸MOL文件

CAS号：

52240-19-4

中文名称：

反式-2-(p-氯苯甲酰基)-1-环己烷羧酸

英文名称：

trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid

分子式：

C₁₄H₁₅ClO₃

分子量：

266.720103502274

反式-2-(p-氯苯甲酰基)-1-环己烷羧酸(52240-19-4)名称与标识符

名称

中文别名：

反-2-(P-氯苯甲酰)-1-环己羧酸;反式-2-(p-氯苯甲酰基)-1-环己烷羧酸;

英文别名：

trans-2-(p-Chlorobenzoyl)-1-cyclohexanecarboxylic acid;(1R,2R)-2-(4-chlorobenzoyl)cyclohexane-1-carboxylate;trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid;cis-2-p-chlorobenzoyl-1-cyclohexanecarboxylic acid;MFCD00800524;trans-2-(4-Chlorobenzoyl)cyclohexanecarboxylic acid;rel-(1R,2R)-2-(4-Chlorobenzoyl)cyclohexanecarboxylic acid;52240-19-4;DTXSID301197712;SCHEMBL11531095;AKOS016017495;TRANS-2-(P-CHLOROBENZOYL)-1-CYCLOHEXANECARBOXYLIC ACID, 98;trans-2-(p-Chlorobenzoyl)-1-cyclohexanecarboxylic acid,98;DB-309430;(1R,2R)-2-(4-chlorobenzoyl)cyclohexane-1-carboxylic acid;trans-2-(4-Chlorobenzoyl)cyclohexanecarboxylicacid;

标识符

MDL：

MFCD00800524

InChIKey：

LFHRQJKEWRETIE-VXGBXAGGSA-N

Inchi：

1S/C14H15ClO3/c15-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)14(17)18/h5-8,11-12H,1-4H2,(H,17,18)/t11-,12-/m1/s1

SMILES：

ClC1C=CC(=CC=1)C([C@@H]1CCCC[C@H]1C(=O)O)=O

反式-2-(p-氯苯甲酰基)-1-环己烷羧酸(52240-19-4)物化性质

实验特性

LogP : 2.07900
PSA : 57.20000
熔点 : 157-161°C
颜色与性状 : 无可用
溶解性 : 无可用
密度 : 1.2034 (estimate)

计算特性

精确分子量 : 265.06300
氢键供体数量 : 1
氢键受体数量 : 3
可旋转化学键数量 : 3
同位素质量 : 266.0709720g/mol
重原子数量 : 18
复杂度 : 316
同位素原子数量 : 0
确定原子立构中心数量 : 2
不确定原子立构中心数量 : 0
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） : 4
表面电荷 : -1
拓扑分子极性表面积 : 57.2

反式-2-(p-氯苯甲酰基)-1-环己烷羧酸(52240-19-4)海关数据

海关编码：

2918300090

海关数据：

中国海关编码：

2918300090

概述：

2918300090 其他含醛基或酮基不含其他含氧基羧酸（包括酸酐、酰卤化物、过氧化物和过氧酸及该税号的衍生物）. 增值税率:17.0% 退税率:9.0% 监管条件:无最惠国关税:6.5% 普通关税:30.0%

申报要素：

品名, 成分含量, 用途

Summary：

2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

反式-2-(p-氯苯甲酰基)-1-环己烷羧酸(52240-19-4)推荐厂家更多厂家(1)

公司名称	手机号/电话	联系人	QQ	微信	询单
金锦乐（湖南）化学有限公司		金锦乐	1226360695		询单

反式-2-(p-氯苯甲酰基)-1-环己烷羧酸(52240-19-4) MSDS

基础信息

Name:	trans-2-(p-Chlorobenzoyl)-1-cyclohexanecarboxylic acid 98% Material Safety Data Sheet
Synonym:
CAS:	52240-19-4

Section 1 - Chemical Product ? MSDS Name:trans-2-(p-Chlorobenzoyl)-1-cyclohexanecarboxylic acid 98% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
52240-19-4	trans-2-(p-Chlorobenzoyl)-1-cyclohexan	98%	unlisted

Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
Non-irritating to the eyes.
Skin:
Non-irritating to the skin.
Ingestion:
The toxicological properties of this substance have not been fully investigated.
Inhalation:
The toxicological properties of this substance have not been fully investigated.
Chronic:
Not available.

Section 4 - FIRST AID MEASURES
? Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately. Get medical aid.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
? General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or chemical foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
? General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container.

Section 7 - HANDLING and STORAGE
? Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
? Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 52240-19-4: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Crystalline powder
Color: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 157 - 161 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water: soluble in ethanol
Specific Gravity/Density:
Molecular Formula: C14H15O3Cl
Molecular Weight: 266.71

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Not available.
Incompatibilities with Other Materials:
Not available.
Hazardous Decomposition Products:
Hydrogen chloride, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 52240-19-4 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
trans-2-(p-Chlorobenzoyl)-1-cyclohexanecarboxylic acid, 98% - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION
?

Section 13 - DISPOSAL CONSIDERATIONS
? Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
?
IATA
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 52240-19-4: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 52240-19-4 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 52240-19-4 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A