CAS Number2051-95-8
SynonymsPropionic acid,3-benzoyl; 3-Benzoylpropanoic acid; 4-keto-4-phenyl-butyric acid; EINECS 218-135-0; Benzoylpropionic acid; 3-Benzoylpropionic acid; 4-Oxo-4-phenylbutanoic acid; Propanoic acid,3-benzoyl; 4-Oxo-4-phenylbutyric Acid; 4-phenyl-4-oxobutyric acid; MFCD00002792; 4-OXO-4-PHENYL-BUTYRIC ACID
Molecular FormulaC6H5COCH2CH2COOH
Molecular Weight178.18
Purity99%
Density1.2±0.1 g/cm3
Boiling Point359.7±25.0 °C at 760 mmHg
Melting Point114-117 °C (lit.)
Appearancecrystals
EINECS218-135-0
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 2051-95-8 |
| Catalog No. | 2A-9027912 |
| Chinese Name | 3-苯甲酰丙酸 |
| Synonyms | Propionic acid,3-benzoyl; 3-Benzoylpropanoic acid; 4-keto-4-phenyl-butyric acid; EINECS 218-135-0; Benzoylpropionic acid; 3-Benzoylpropionic acid; 4-Oxo-4-phenylbutanoic acid; Propanoic acid,3-benzoyl; 4-Oxo-4-phenylbutyric Acid; 4-phenyl-4-oxobutyric acid; MFCD00002792; 4-OXO-4-PHENYL-BUTYRIC ACID |
| Molecular Formula | C6H5COCH2CH2COOH |
| Molecular Weight | 178.18 |
| Purity | 99 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 359.7±25.0 °C at 760 mmHg |
| Melting Point | 114-117 °C (lit.) |
| Appearance | crystals |
| Storage Condition | Keep the container sealed and stored in a cool, dr |
| EINECS | 218-135-0 |
| PubChem ID | 24891586 |
| MDL Number | MFCD00002792 |
| SMILES | OC(=O)CCC(=O)c1ccccc1 |
| InChI | 1S/C10H10O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13) |
| InChI Key | KMQLIDDEQAJAGJ-UHFFFAOYSA-N |
| Beilstein/REAXYS | 639757 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | transportation |
| MSDS | msds/27912_1_2051_95_8.pdf |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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