CAS Number1131-94-8
Synonyms(3-Hydroxy-4-methoxyphenyl)acetic acid; MFCD00016829; 2-(3-hydroxy-4-methoxyphenyl)acetic acid; 3-Hydroxy-4-methoxybenzeneacetic acid; Homoisovanillic acid; QV1R CQ DO1; 3-Hydroxy-4-methoxyphenylacetic acid
Molecular FormulaC9H10O4
Molecular Weight182.17
Purity97%
Density1.3±0.1 g/cm3
Boiling Point371.3±27.0 °C at 760 mmHg
Melting Point127-132 °C
Appearancesolid
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1131-94-8 |
| Catalog No. | 2A-9004540 |
| Chinese Name | 3-羟基-4-甲氧基苯乙酸 |
| Synonyms | (3-Hydroxy-4-methoxyphenyl)acetic acid; MFCD00016829; 2-(3-hydroxy-4-methoxyphenyl)acetic acid; 3-Hydroxy-4-methoxybenzeneacetic acid; Homoisovanillic acid; QV1R CQ DO1; 3-Hydroxy-4-methoxyphenylacetic acid |
| Molecular Formula | C9H10O4 |
| Molecular Weight | 182.17 |
| Purity | 97 |
| Density | 1.3±0.1 g/cm3 |
| Boiling Point | 371.3±27.0 °C at 760 mmHg |
| Melting Point | 127-132 °C |
| Appearance | solid |
| Storage Condition | Keep the receptacle sealed, stored in a cool, dry |
| Application | Isohomovanillic acid (3-Hydroxy-4-methoxyphenylacetic acid) is extracted from urine at pH 2 with ethyl acetate. Isohomovanillic acid is not apparent in the urine of many normal humans. |
| HTC | 2918990090 |
| PubChem ID | 329763388 |
| MDL Number | MFCD00016829 |
| SMILES | COc1ccc(CC(O)=O)cc1O |
| InChI | 1S/C9H10O4/c1-13-8-3-2-6(4-7(8)10)5-9(11)12/h2-4,10H,5H2,1H3,(H,11,12) |
| InChI Key | BWXLCOBSWMQCGP-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | Transport |
| MSDS | msds/4540_1_1131_94_8.pdf |
| Bioactivity | Isohomovanillic acid (3-Hydroxy-4-methoxyphenylacetic acid) is extracted from urine at pH 2 by ethyl acetate. Isohomovanillic acid is not found in appreciable values in many normal human urines[1]. Related Catalog Research Areas >> Cancer Target Human Endogenous Metabolite References [1]. Comoy E, et al. Iso-homovanillic acid determination in human urine. Clin Chim Acta. 1971 Dec;35(2):369-75. Chemical & Physical Properties Density 1.3±0.1 g/cm3 Boiling Point 371.3±27.0 °C at 760 mmHg Melting Point 128 °C Molecular Formula C9H10O4 Molecular Weight 182.173 Flash Point 153.1±17.2 °C Exact Mass 182.057907 PSA 66.76000 LogP 0.47 Vapour Pressure 0.0±0.9 mmHg at 25°C Index of Refraction 1.573 InChIKey BWXLCOBSWMQCGP-UHFFFAOYSA-N SMILES COc1ccc(CC(=O)O)cc1O |
| Use of | Isohomovanillic acid (3-Hydroxy-4-methoxyphenylacetic acid) is extracted from urine at pH 2 by ethyl acetate. Isohomovanillic acid is not found in appreciable values in many normal human urines[1]. Properties Name isohomovanillic acid Synonym More Synonyms 3-Hydroxy-4-methoxyphenylacetic acid Biological Activity Description Isohomovanillic acid (3-Hydroxy-4-methoxyphenylacetic acid) is extracted from urine at pH 2 by ethyl acetate. Isohomovanillic acid is not found in appreciable values in many normal human urines[1]. Related Catalog Research Areas >> Cancer Human Endogenous Metabolite References [1]. Comoy E, et al. Iso-homovanillic acid determination in human urine. Clin Chim Acta. 1971 Dec;35(2):369-75. Chemical & Physical Properties Molecular Formula C9H10O4 Exact Mass 182.057907 PSA 66.76000 Index of Refraction 1.573 InChIKey BWXLCOBSWMQCGP-UHFFFAOYSA-N |
| Tax Rebate | 13.0% |
| 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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