CAS Number611-73-4
SynonymsOxo(phenyl)acetic acid; α-Oxobenzeneacetic acid; 2-oxo-2-phenylacetic acid; Phenylgloxylic acid; phenylglyoxylate; Oxo-phenyl-acetic acid; benzeneglyoxylic acid; Oxophenylacetic acid; Benzoylformic acid; Phenylglyoxylic acid; a-Oxobenzeneacetic Acid; Benzoyl formoic acid; phenylglyoxalic acid; EINECS 210-278-7; 2-phenylethanoic acid; α-Oxophenylacetic acid; Benzoylformate; MFCD00002575
Molecular FormulaC6H5COCOOH
Molecular Weight150.13
Purity97%
Density1.3±0.1 g/cm3
Boiling Point258.6±13.0 °C at 760 mmHg
Melting Point62-65 °C (lit.)
Appearancecrystals
EINECS210-278-7
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 611-73-4 |
| Catalog No. | 2A-9024142 |
| Chinese Name | 苯甲酰甲酸 |
| Synonyms | Oxo(phenyl)acetic acid; α-Oxobenzeneacetic acid; 2-oxo-2-phenylacetic acid; Phenylgloxylic acid; phenylglyoxylate; Oxo-phenyl-acetic acid; benzeneglyoxylic acid; Oxophenylacetic acid; Benzoylformic acid; Phenylglyoxylic acid; a-Oxobenzeneacetic Acid; Benzoyl formoic acid; phenylglyoxalic acid; EINECS 210-278-7; 2-phenylethanoic acid; α-Oxophenylacetic acid; Benzoylformate; MFCD00002575 |
| Molecular Formula | C6H5COCOOH |
| Molecular Weight | 150.13 |
| Purity | 97 |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 258.6±13.0 °C at 760 mmHg |
| Melting Point | 62-65 °C (lit.) |
| Appearance | crystals |
| Water Solubility | methanol: 0.1 g/mL, clear |
| Storage Condition | Seal the container and store it in a sealed main c |
| Application | Phenylglyoxylic acid (Benzoylformic acid) is a metabolite of ethylbenzene and styrene (EB/S) and can be used as a biomarker of human exposure to EB/S. |
| EINECS | 210-278-7 |
| HTC | 29183000 |
| PubChem ID | 24891579 |
| MDL Number | MFCD00002575 |
| SMILES | OC(=O)C(=O)c1ccccc1 |
| InChI | 1S/C8H6O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5H,(H,10,11) |
| InChI Key | FAQJJMHZNSSFSM-UHFFFAOYSA-N |
| Beilstein/REAXYS | 606718 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| MSDS | msds/24142_2_611_73_4.pdf |
| Bioactivity | Phenylglyoxylic acid (Benzoylformic acid) is a metabolite of ethylbenzene and styrene (EB/S) and can be used as a biomarker of exposure to EB/S in human[1]. Related Catalog Research Areas >> Metabolic Disease References [1]. Capella KM, et al. Ethylbenzene and styrene exposure in the United States based on urinary mandelic acid and phenylglyoxylic acid: NHANES 2005-2006 and 2011-2012. Environ Res. 2019 Apr;171:101-110. Chemical & Physical Properties Density 1.3±0.1 g/cm3 Boiling Point 258.6±13.0 °C at 760 mmHg Melting Point 62-65 °C(lit.) Molecular Formula C8H6O3 Molecular Weight 150.131 Flash Point 124.4±16.3 °C Exact Mass 150.031693 PSA 54.37000 LogP 0.69 Vapour Pressure 0.0±0.6 mmHg at 25°C Index of Refraction 1.569 InChIKey FAQJJMHZNSSFSM-UHFFFAOYSA-N SMILES O=C(O)C(=O)c1ccccc1 Storage condition Refrigerator Water Solubility methanol: 0.1 g/mL, clear |
| Use of | Phenylglyoxylic acid (Benzoylformic acid) is a metabolite of ethylbenzene and styrene (EB/S) and can be used as a biomarker of exposure to EB/S in human[1]. Properties Articles31 Name phenylglyoxylic acid Synonym More Synonyms Phenylglyoxylic acid Biological Activity Description Phenylglyoxylic acid (Benzoylformic acid) is a metabolite of ethylbenzene and styrene (EB/S) and can be used as a biomarker of exposure to EB/S in human[1]. Related Catalog Research Areas >> Metabolic Disease References [1]. Capella KM, et al. Ethylbenzene and styrene exposure in the United States based on urinary mandelic acid and phenylglyoxylic acid: NHANES 2005-2006 and 2011-2012. Environ Res. 2019 Apr;171:101-110. Chemical & Physical Properties Molecular Formula C8H6O3 Exact Mass 150.031693 PSA 54.37000 Index of Refraction 1.569 InChIKey FAQJJMHZNSSFSM-UHFFFAOYSA-N Storage condition Refrigerator |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Purity: 0.0% |
| MSDS Transport Info | Module 14. Shipping information United Nations classification: inconsistent with United Nations classification standards UN number: not specified |
| Related Products in Specialty Chemicals | ||
|---|---|---|
| 2-Chlorobenzyl bromide | 611-17-6 | 2A-9024130 |
| 2-Chlorobenzyl chloride | 611-19-8 | 2A-9024131 |
| Tectoridin | 611-40-5 | 2A-9024138 |
| Isobutyrophenone | 611-70-1 | 2A-9024140 |
| DL-Mandelic acid | 611-72-3 | 2A-9024141 |
| N,N-Dimethylbenzamide | 611-74-5 | 2A-9024143 |
| Bromhexine | 3572-43-8 | 2A-9024144 |
| 4-Methoxybenzophenone | 611-94-9 | 2A-9024146 |
| 4,4'-Dimethylbenzophenone | 611-97-2 | 2A-9024148 |
| 1,1-Diphenylethane | 612-00-0 | 2A-9024151 |
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