CAS Number625-08-1
SynonymsMFCD00059081; Beta-Hydroxyisovaleric Acid; 3-hydroxy-3-methylbutanoic acid
Molecular FormulaC5H10O3
Molecular Weight118.13
Purity≥95.0 (T)%
Density0.938 g/mL at 25 °C(lit.)
Boiling Point88 °C/1 mmHg (lit.)
Melting Point−80 °C (lit.)
AppearanceColorless to light yellow liquid
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 625-08-1 |
| Catalog No. | 2A-9024468 |
| Chinese Name | β-羟基异戊酸 |
| Synonyms | MFCD00059081; Beta-Hydroxyisovaleric Acid; 3-hydroxy-3-methylbutanoic acid |
| Molecular Formula | C5H10O3 |
| Molecular Weight | 118.13 |
| Purity | ≥95.0 (T) |
| Density | 0.938 g/mL at 25 °C(lit.) |
| Boiling Point | 88 °C/1 mmHg (lit.) |
| Melting Point | −80 °C (lit.) |
| Appearance | Colorless to light yellow liquid |
| Storage Condition | Store in an airtight container in a cool, dry plac |
| Application | 3-Hydroxyisovaleric acid is a normal human metabolite excreted in urine. |
| HTC | 2918199090 |
| PubChem ID | 57651529 |
| MDL Number | MFCD00059081 |
| SMILES | CC(C)(O)CC(O)=O |
| InChI | 1S/C5H10O3/c1-5(2,8)3-4(6)7/h8H,3H2,1-2H3,(H,6,7) |
| InChI Key | AXFYFNCPONWUHW-UHFFFAOYSA-N |
| Beilstein/REAXYS | 1743952 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | transportation |
| MSDS | msds/24468_1_625_08_1.pdf |
| Bioactivity | 3-Hydroxyisovaleric acid is a normal human metabolite excreted in the urine. Related Catalog Natural Products >> Acids and Aldehydes Research Areas >> Others Target Human Endogenous Metabolite References [1]. Mock NI, et al. Increased urinary excretion of 3-hydroxyisovaleric acid and decreased urinary excretion of biotin are sensitive early indicators of decreased biotin status in experimental biotin deficiency. 1997 Apr;65(4):951-8. Chemical & Physical Properties Density 0.938 g/mL at 25 °C(lit.) Boiling Point 88 °C1 mm Hg(lit.) Melting Point −80 °C(lit.) Molecular Formula C5H10O3 Molecular Weight 118.13100 Flash Point 113 °C Exact Mass 118.06300 PSA 57.53000 LogP 0.23200 Index of Refraction n20/D 1.4415(lit.) InChIKey AXFYFNCPONWUHW-UHFFFAOYSA-N SMILES CC(C)(O)CC(=O)O Storage condition Refrigerator |
| Use of | 3-Hydroxyisovaleric acid is a normal human metabolite excreted in the urine. Properties Articles48 Name 3-hydroxyisovaleric acid Synonym More Synonyms 3-Hydroxyisovaleric acid Biological Activity Description 3-Hydroxyisovaleric acid is a normal human metabolite excreted in the urine. Related Catalog Natural Products >> Acids and Aldehydes Research Areas >> Others Human Endogenous Metabolite References [1]. Mock NI, et al. Increased urinary excretion of 3-hydroxyisovaleric acid and decreased urinary excretion of biotin are sensitive early indicators of decreased biotin status in experimental biotin deficiency. 1997 Apr;65(4):951-8. Chemical & Physical Properties Molecular Formula C5H10O3 Exact Mass 118.06300 PSA 57.53000 LogP 0.23200 InChIKey AXFYFNCPONWUHW-UHFFFAOYSA-N SMILES CC(C)(O)CC(=O)O Storage condition Refrigerator |
| Tax Rebate | 9.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 30.0% |
| Transport Info | Product name: Purity: 96.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Transport Dangerous Regulations: -International Air Transport Dangerous Regulations: 3334 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods Aviation regulated liquid, n.o.s. (Butanoic acid, 3-hydroxy-3-methyl-) 14.3 Transport hazard categories European land transport danger code: -International sea transport danger code: -International air transport danger code: 9 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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