CAS 611-73-4|Phenylglyoxylic acid
| Common Name | Phenylglyoxylic acid | ||
|---|---|---|---|
| CAS Number | 611-73-4 | Molecular Weight | 150.131 |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 258.6±13.0 °C at 760 mmHg |
| Molecular Formula | C8H6O3 | Melting Point | 62-65 °C(lit.) |
| MSDS | ChineseUSA | Flash Point | 124.4±16.3 °C |
| Symbol | GHS07 | Signal Word | Warning |
Names
| Name | phenylglyoxylic acid |
|---|---|
| Synonym | More Synonyms |
Phenylglyoxylic acid BiologicalActivity
| 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
| 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 |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 180 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#04110
Safety Information
| Symbol | GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S28-S36-S28A-S24-S22 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | DA1480000 |
| HS Code | 29183000 |
Customs
| HS Code | 2918300090 |
|---|---|
| Summary | 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0% |
Articles31
More Articles| Development of a multi-residue method in a fetal matrix: analysis of meconium. Anal. Bioanal. Chem 406(30) , 7785-97, (2014) Meconium is the earliest stool of newborns. It is a complex matrix that reflects the degree of fetal exposure to environmental pollutants. To investigate exposure to xenobiotics, an analytical method ... | |
| Development of liquid chromatography methods coupled to mass spectrometry for the analysis of substances with a wide variety of polarity in meconium. Talanta 138 , 231-9, (2015) Meconium is the first fecal excretion of newborns. This complex accumulative matrix allows assessing the exposure of the fetus to xenobiotics during the last 6 months of pregnancy. To determine the ev... | |
| Copper/alpha-ketocarboxylate chemistry with supporting peralkylated diamines: reactivity of copper(I) complexes and dicopper-oxygen intermediates. Inorg. Chem. 49(7) , 3531-9, (2010) To further understand copper-promoted oxidation reactions, the Cu(I) complexes LCuX (L = N,N'-di-tert-butyl-N,N'-dimethylethylenediamine; X = benzoylformate (BF) or p-nitro-benzoylformate) were synthe... |
Synonyms
| Oxo(phenyl)acetic acid |
| α-Ketophenylacetic acid |
| Benzeneacetic acid, α-oxo- (9CI) |
| α-Oxobenzeneacetic acid |
| 2-oxo-2-phenylacetic acid |
| Phenylgloxylic acid |
| phenylglyoxylate |
| UNII-2PZL5A0W0M |
| Oxo-phenyl-acetic acid |
| benzeneglyoxylic acid |
| Oxophenylacetic acid |
| Benzoylformic acid |
| Phenylglyoxylic acid |
| a-Oxobenzeneacetic Acid |
| a-Ketophenylacetic Acid |
| Benzoyl formoic acid |
| phenylglyoxalic acid |
| Benzeneacetic acid, α-oxo- |
| Formic acid, benzoyl- |
| EINECS 210-278-7 |
| 2-phenylethanoic acid |
| α-Oxophenylacetic acid |
| Benzoylformate |
| Glyoxylic acid, phenyl- (8CI) |
| MFCD00002575 |
| glyoxylic acid, phenyl- |
