26896-20-8 (新癸酸,Neodecanoic acid)

结构式:
CAS号:
26896-20-8
中文名称:
新癸酸
英文名称:
Neodecanoic acid
分子式:
C10H20O2
分子量:
172.264603614807
简介:
新癸酸是在α碳原子上有支链的一系列癸酸的同分异构体的统称,适用于橡胶与镀黄铜、镀锌的钢丝、缆丝及金属扳材和不同厚度的黄钢底层,各种裸钢的粘合。是子午线轮胎橡胶与金属优异的粘合增进剂。。

新癸酸(26896-20-8)名称与标识符

名称

中文别名:
新癸酸;叔癸酸;2-乙基-2,5-二甲基己酸;新癸酸(叔碳酸) shina-10;新癸酸, 异构体混合物;新癸酸钴;十碳叔碳酸;十碳酸;新癸酸;叔癸酸;新癸酸,异构体混合物;7,7-二甲基葵酸;新葵酸;新癸酸PG;新癸酸(叔碳酸);
英文别名:
7,7-Dimethyloctanoic acid;VERSATIC 10 ACID;neo-decanoic;Wiltz-65;2,2,3,5-Tetramethylhexanoicacid;neo-decanoicacid,Neodecansre;neo-Decanoicacid,primegrade;Neodecansure;NEO-DECANOIC ACID: TECH., ISOMERIC C10 ACIDS;2-Ethyl-2,5-dimethylhexanoic acid;9,9-Dimethyldecanoic acid;Neododecanoic acid;Topper 5E;Neodecanoic acid;NEO-DECANOIC ACID;New decanoate;AK116933;Rare earth neodecanoate;Neodecanoic acid, rare earth salts;7,7-Dimethyloctanoicacid;neo-decanoic acid, AldrichCPR;YPIFGDQKSSMYHQ-UHFFFAOYSA-N;U878;AX8144114;ST24048788;A818664;Neo decanoic acid;Neodecanoicacid;130776-67-9;FT-0654977;NEO-DECANOICACID;68412-21-5;neo-Decanoic acid, prime grade;SCHEMBL23925;Z1201618722;H10667;Neodecanoic Acid, mixture of isomers;SY066765;DECANOIC ACID, TERT-;AKOS006345516;2,2-DIMETHYLCAPRYLIC ACID;26896-20-8;52627-73-3;CS-W022922;EN300-198006;3HN3T2UTE6;MFCD00068291;AS-17386;DTXSID00866704;EINECS 270-175-8;Einecs 248-093-9;Epa pesticide chemical code 097501;Neo Decanoic Acid PG;Neodecanoic acid, 98%, mixture of isomers;

标识符

MDL:
MFCD00068291
InChIKey:
YPIFGDQKSSMYHQ-UHFFFAOYSA-N
Inchi:
1S/C10H20O2/c1-10(2,3)8-6-4-5-7-9(11)12/h4-8H2,1-3H3,(H,11,12)
SMILES:
OC(CCCCCC(C)(C)C)=O

新癸酸(26896-20-8)物化性质

实验特性

  • LogP : 3.06760
  • PSA : 37.30000
  • 折射率 : 1.4192 (estimate)
  • 沸点 : 243-253°C
  • 熔点 : No data available
  • 闪点 : 122 °C
  • 溶解度 : 可溶于氯仿(少许)、甲醇(少许)
  • 颜色与性状 : 液体
  • 溶解性 : 无可用
  • 密度 : 0.9

计算特性

  • 精确分子量 : 172.14600
  • 氢键供体数量 : 1
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 6
  • 同位素质量 : 172.14633
  • 重原子数量 : 12
  • 复杂度 : 133
  • 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 : 1
  • 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) : 3.7
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 37.3

新癸酸(26896-20-8)国际标准相关数据

EINECS:
270-175-8

新癸酸(26896-20-8)海关数据

海关编码:
2915900090
海关数据:

中国海关编码:

2915900090

概述:

2915900090. 其他饱和无环一元羧酸及其酸酐(酰卤、过氧)化物、过氧酸及其卤化、硝化、磺化、亚硝化衍生物. 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:5.5%. 普通关税:30.0%

申报要素:

品名, 成分含量, 用途

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
M.进口商品检验
N.出口商品检验

Summary:

2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%

新癸酸(26896-20-8)生产方法和用途

用途:
医药中间体

新癸酸(26896-20-8) MSDS

基础信息


Section 1: Product Identification
   Chemical Name:       neo-Decanoic acid, prime grade    
   CAS Registry Number:       26896-20-8    
   Formula:       isomeric C10 acids    
   EINECS Number:       248-093-9    
   Chemical Family:       Aliphatic carboxylic acid    
   Synonym:       Neodecanoic acid    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title Compound       26896-20-8       100%       no data       no data    

Section 3: Hazards Identification
   Emergency Overview:       Irritating to skin, eyes and respiratory tract.    
   Primary Routes of Exposure:       Ingestion, inhalation, skin, eyes    
   Eye Contact:       Causes moderate irritation to the eyes.    
   Skin Contact:       Causes moderate irritation to the skin.    
   Inhalation:       Causes mild irritation to the nose, mucous membranes, and respiratory tract.    
   Ingestion:       No specific information is available on the physiological effects of ingestion.    
   Acute Health Affects:       Irritating to skin, eyes, and respiratory tract.    
   Chronic Health Affects:       No information available on long-term chronic effects.    
   NTP:       No    
   IARC:       No    
   OSHA:       No    

SECTION 4: First Aid Measures
   Immediately flush the eyes with copious amounts of water for at least 10-15 minutes. A victim may need
   Eye Exposure:
   assistance in keeping their eye lids open. Get immediate medical attention.
   Wash the affected area with water. Remove contaminated clothes if necessary. Seek medical assistance if
   Skin Exposure:
   irritation persists.
   Remove the victim to fresh air. Closely monitor the victim for signs of respiratory problems, such as difficulty
   Inhalation:
   in breathing, coughing, wheezing, or pain. In such cases seek immediate medical assistance.
   Seek medical attention immediately. Keep the victim calm. Give the victim water (only if conscious). Induce
   Ingestion:
   vomiting only if directed by medical personnel.

SECTION 5: Fire Fighting Measures
   Flash Point:       not applicable    
   Autoignition Temperature:       no data    
   Explosion Limits:       no data    
   Extinguishing Medium:       dry chemical, carbon dioxide, water, or foam.    
   Fire fighters should be equipped with a NIOSH approved positive pressure self-contained breathing apparatus
   Special Fire Fighting Procedures:
   and full protective clothing.
   Hazardous Combustion and       If involved in a fire this material may emit toxic organic fumes, carbon monoxide, and carbon dioxide.    
   Decomposion Products:
   Unusual Fire or Explosion Hazards: No unusual fire or explosion hazards.

SECTION 6: Accidental Release Measures
   Small spills can be mixed with vermiculite, sodium carbonate or other suitable non combustible adsorbent and
   Spill and Leak Procedures:
   swept up.

SECTION 7: Handling and Storage
   Handling and Storage:       No special precautions needed in handling and storage.    

SECTION 8: Exposure Controls and Personal Protection
   Eye Protection:       Always wear approved safety glasses when handling a chemical substance in the laboratory.    
   Skin Protection:       Wear protective clothing and gloves. Consult with glove manufacturer to determine the proper type of glove.    
   Ventilation:       If possible, handle the material in an efficient fume hood.    
   If ventilation is not available a respirator should be worn. The use of respirators requires a Respirator
   Respirator:
   Protection Program to be in compliance with 29 CFR 1910.134.
   Ventilation:       If possible, handle the material in an efficient fume hood.    
   Additional Protection:       No additional protection required.    

SECTION 9: Physical and Chemical Properties
   Color and Form:       colorless liq.    
   Molecular Weight:       not applicable    
   Melting Point:       no data    
   Boiling Point:       243-253°    
   Vapor Pressure:       no data    
   Specific Gravity:       no data    
   Odor:       none    
   Solubility in Water:       insoluble    

SECTION 10: Stability and Reactivity
   Stability:       air and moisture stable    
   Hazardous Polymerization:       no hazardous polymerization    
   Conditions to Avoid:       none    
   Incompatibility:       active metals    
   Decomposition Products:       carbon monoxide, carbon dioxide, and organic fumes.    

SECTION 11: Toxicological Information
   Oral(rat); LD50: 2000mg/kg. Administration onto skin(rabbit); LD50: >3160mg/kg. Inhalation(rat); LC50:
   RTECS Data:
   >3000mg/m3/6H. Inhalation(mouse); LC50: >3000mg/m3/6H.
   Carcinogenic Effects:       No data available    
   Mutagenic Effects:       No data available    
   Tetratogenic Effects:       No data available    

SECTION 12: Ecological Information
   Ecological Information:       No information available    

SECTION 13: Disposal Considerations
   Disposal:       Dispose of according to federal, state, and local regulations.    

SECTION 14: Transportation
   Shipping Name (CFR):       Non-hazardous    
   Hazard Class (CFR):       NA    
   Additional Hazard Class (CFR):       NA    
   Packaging Group (CFR):       NA    
   UN ID Number (CFR):       NA    
   Shipping Name (IATA):       Non-hazardous    
   Hazard Class (IATA):       NA    
   Additional Hazard Class (IATA):       NA    
   Packaging Group (IATA):       NA    
   UN ID Number (IATA):       NA    

SECTION 15: Regulatory Information
   TSCA:       Listed in the TSCA inventory.    
   SARA (Title 313):       Title compound not listed.    
   Second Ingredient:       none    


SECTION 16 - ADDITIONAL INFORMATION
N/A