CAS Number612-35-1
Synonyms2-Benzylbenzoic acid; o-Benzylbenzoic acid; 2-Carboxydiphenylmethane; 2-BenzYl-Benzoic Acid; EINECS 210-305-2; MFCD00002484
Molecular FormulaC6H5CH2C6H4CO2H
Molecular Weight212.24
Purity97%
Density1.2±0.1 g/cm3
Boiling Point363.2±11.0 °C at 760 mmHg
Melting Point112-115 °C (lit.)
Appearancesolid
EINECS210-305-2
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 612-35-1 |
| Catalog No. | 2A-9086273 |
| Chinese Name | 2-苄基苯甲酸 |
| Synonyms | 2-Benzylbenzoic acid; o-Benzylbenzoic acid; 2-Carboxydiphenylmethane; 2-BenzYl-Benzoic Acid; EINECS 210-305-2; MFCD00002484 |
| Molecular Formula | C6H5CH2C6H4CO2H |
| Molecular Weight | 212.24 |
| Purity | 97 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 363.2±11.0 °C at 760 mmHg |
| Melting Point | 112-115 °C (lit.) |
| Appearance | solid |
| Storage Condition | Room temperature, sealed, protected from light, ve |
| Application | 2-Benzylbenzoic acid can be used in compound synthesis [1]. |
| EINECS | 210-305-2 |
| HTC | 2916399090 |
| PubChem ID | 24898441 |
| MDL Number | MFCD00002484 |
| SMILES | OC(=O)c1ccccc1Cc2ccccc2 |
| InChI | 1S/C14H12O2/c15-14(16)13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,15,16) |
| InChI Key | FESDHLLVLYZNFY-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | transportation |
| MSDS | msds/86273_1_612_35_1.pdf |
| Bioactivity | 2-Benzylbenzoic acid can be used for compound synthesis[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others References [1]. Christopeit T, et al. Discovery of Novel Inhibitor Scaffolds against the Metallo-β-lactamase VIM-2 by Surface Plasmon Resonance (SPR) Based Fragment Screening. J Med Chem. 2015 Nov 12;58(21):8671-82. Chemical & Physical Properties Density 1.2±0.1 g/cm3 Boiling Point 363.2±11.0 °C at 760 mmHg Melting Point 112-115ºC(lit.) Molecular Formula C14H12O2 Molecular Weight 212.244 Flash Point 168.6±13.9 °C Exact Mass 212.083725 PSA 37.30000 LogP 3.88 Vapour Pressure 0.0±0.9 mmHg at 25°C Index of Refraction 1.605 InChIKey FESDHLLVLYZNFY-UHFFFAOYSA-N SMILES O=C(O)c1ccccc1Cc1ccccc1 |
| Use of | 2-Benzylbenzoic acid can be used for compound synthesis[1]. Properties Name 2-Benzylbenzoic acid Synonym More Synonyms 2-BENZYLBENZOIC ACID Biological Activity Description 2-Benzylbenzoic acid can be used for compound synthesis[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others References [1]. Christopeit T, et al. Discovery of Novel Inhibitor Scaffolds against the Metallo-β-lactamase VIM-2 by Surface Plasmon Resonance (SPR) Based Fragment Screening. J Med Chem. 2015 Nov 12;58(21):8671-82. Chemical & Physical Properties Molecular Formula C14H12O2 Exact Mass 212.083725 PSA 37.30000 Index of Refraction 1.605 InChIKey FESDHLLVLYZNFY-UHFFFAOYSA-N |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Purity: 97.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN 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: No dangerous goods IMDG Code: No dangerous goods International Air Transport Dangerous Regulations: No 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 precautions for users No data available |
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