CAS Number2270-20-4
Synonyms5-Phenylpentanoic acid; 5-(phenyl)valeric acid; Valeric acid,5-phenyl; 5-Phenylvalerate; Phenylpentanoic acid; 5-Phenyl-pentanoic acid; Benzenepentanoic acid; Phenylvaleric acid; EINECS 218-872-8; 5-Phenyl Valeric acid; 5-Phenylvaleric acid; 5-phenyl-n-valeric acid; MFCD00004416
Molecular FormulaC6H5CH2CH2CH2CH2COOH
Molecular Weight178.23
Purity99%
Density1.1±0.1 g/cm3
Boiling Point177-178 °C/13 mmHg (lit.)
Melting Point58-60 °C (lit.)
Appearancecrystals
EINECS218-872-8
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 2270-20-4 |
| Catalog No. | 2A-9028245 |
| Chinese Name | 5-苯基戊酸 |
| Synonyms | 5-Phenylpentanoic acid; 5-(phenyl)valeric acid; Valeric acid,5-phenyl; 5-Phenylvalerate; Phenylpentanoic acid; 5-Phenyl-pentanoic acid; Benzenepentanoic acid; Phenylvaleric acid; EINECS 218-872-8; 5-Phenyl Valeric acid; 5-Phenylvaleric acid; 5-phenyl-n-valeric acid; MFCD00004416 |
| Molecular Formula | C6H5CH2CH2CH2CH2COOH |
| Molecular Weight | 178.23 |
| Purity | 99 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 177-178 °C/13 mmHg (lit.) |
| Melting Point | 58-60 °C (lit.) |
| Appearance | crystals |
| Storage Condition | Keep container sealed, placed in a tight-fitting c |
| Application | 5-Phenylvaleric acid (5-Phenylpentanoic acid) is a bacterially derived valeric acid that is occasionally found in human body fluids. |
| EINECS | 218-872-8 |
| HTC | 29163900 |
| PubChem ID | 24898447 |
| MDL Number | MFCD00004416 |
| SMILES | OC(=O)CCCCc1ccccc1 |
| InChI | 1S/C11H14O2/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,12,13) |
| InChI Key | BYHDDXPKOZIZRV-UHFFFAOYSA-N |
| Beilstein/REAXYS | 2049062 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | transportation |
| MSDS | msds/28245_1_2270_20_4.pdf |
| Bioactivity | 5-Phenylvaleric acid (5-Phenylpentanoic acid) is a pentanoic acid of bacterial origin, occasionally found in human biofluids. Related Catalog Research Areas >> Others Chemical & Physical Properties Density 1.1±0.1 g/cm3 Boiling Point 308.5±0.0 °C at 760 mmHg Melting Point 58-60 °C(lit.) Molecular Formula C11H14O2 Molecular Weight 178.228 Flash Point 227.2±17.2 °C Exact Mass 178.099380 PSA 37.30000 LogP 2.70 Vapour Pressure 0.0±0.7 mmHg at 25°C Index of Refraction 1.528 InChIKey BYHDDXPKOZIZRV-UHFFFAOYSA-N SMILES O=C(O)CCCCc1ccccc1 |
| Use of | 5-Phenylvaleric acid (5-Phenylpentanoic acid) is a pentanoic acid of bacterial origin, occasionally found in human biofluids. Properties Name 5-phenylpentanoic acid Synonym More Synonyms 5-Phenylvaleric acid Biological Activity Description 5-Phenylvaleric acid (5-Phenylpentanoic acid) is a pentanoic acid of bacterial origin, occasionally found in human biofluids. Related Catalog Research Areas >> Others Chemical & Physical Properties Molecular Formula C11H14O2 Exact Mass 178.099380 PSA 37.30000 Index of Refraction 1.528 InChIKey BYHDDXPKOZIZRV-UHFFFAOYSA-N |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Purity: 98.0% |
| 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 Names specified by the United Nations (UN) 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 Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available |
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