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| CAS No.: | 646-07-1 |
|---|---|
| Name: | 4-Methylvaleric acid |
| Article Data: | 96 |
| Molecular Structure: | |
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| Formula: | C6H12 O2 |
| Molecular Weight: | 116.16 |
| Synonyms: | Valericacid, 4-methyl- (6CI,8CI); 4,4-Dimethylbutanoic acid; 4-Methylpentanoic acid;4-Methylvaleric acid; Isobutylacetic acid; Isocaproic acid; Isohexanoic acid;Isohexoic acid; NSC 4126 |
| EINECS: | 211-464-0 |
| Density: | 0.922 |
| Melting Point: | -35 ºC |
| Boiling Point: | 200 ºC |
| Flash Point: | 97 ºC |
| Solubility: | INSOLUBLE |
| Appearance: | slightly brown liquid |
| Hazard Symbols: |
 
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| Risk Codes: | R21;R34;R38 |
| Safety: | Moderately toxic by ingestion and skin contact. A skin and eye irritant. When heated to decomposition it emits acrid smoke and fumes. |
| Transport Information: | UN 2810 |
| PSA: | 37.30000 |
| LogP: | 1.50720 |
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Chemistry
IUPAC:4-methylpentanoic acid
CAS:646-07-1
The Molecular formula of Isocaproic acid(646-07-1):C6H12O2
The Molecular Weight of Isocaproic acid(646-07-1):116.16
Synonyms:RARECHEM AL BO 0172;PENTANOIC ACID, 4-METHYL-;3-methylbutanecarboxylicacid;4,4-Dimethylbutanoic acid;4,4-Dimethylbutanoicacid;4-methyl-pentanoicaci;4-Methylpentansαure;4-Methylvaleriansαure
Density:0.923 g/mL at 25oC(lit.)
Melting Point:-35oC
Boiling Point:199-201oC(lit.)
Flash Point:207oF
Vapour Pressure:0.131 mmHg at 25oC
Appearance:slightly brown liquid
EINECS:211-464-0
Stability:Stable.Incompatible with strong bases, strong oxidizing agents.
Mol File:646-07-1.mol
Uses
Toxicity Data With Reference
| 1. | skn-rbt 465 mg open MOD | UCDS** Union Carbide Data Sheet. (Industrial Medicine and Toxicology Dept., Union Carbide Corp., 270 Park Ave., New York, NY 10017) 2/4 ,1959. | ||
| 2. | eye-rbt 930 µg MLD | UCDS** Union Carbide Data Sheet. (Industrial Medicine and Toxicology Dept., Union Carbide Corp., 270 Park Ave., New York, NY 10017) 2/4 ,1959. | ||
| 3. | orl-rat LD50:2050 mg/kg | UCDS** Union Carbide Data Sheet. (Industrial Medicine and Toxicology Dept., Union Carbide Corp., 270 Park Ave., New York, NY 10017) 2/4 ,1959. | ||
| 4. | skn-rbt LD50:1050 mg/kg | UCDS** Union Carbide Data Sheet. (Industrial Medicine and Toxicology Dept., Union Carbide Corp., 270 Park Ave., New York, NY 10017) 2/4 ,1959. |
Consensus Reports
Safety Profile
Moderately toxic by ingestion and skin contact. A skin and eye irritant. When heated to decomposition it emits acrid smoke and fumes.
Safty informations about Isocaproic acid(646-07-1):
Hazard Codes:Xn,C
Risk Statements:21-38-34
21(Harmful in contact with skin)
38(Irritating to the skin)
34(Causes burns)
Safety Statements:36/37-45-36/37/39-25
36/37(Wear suitable protective clothing and gloves)
45(In case of accident or if you feel unwell, seek medical advice immediately (show label where possible))
36/37/39(Wear suitable protective clothing, gloves and eye/face protection)
25(Avoid contact with eyes)
WGK Germany:3
RTECS:NR2975000
F:13
HS Code:29159080
HazardClass:8
Specification
Storage:Keep away from sources of ignition. Store in a tightly closed container. Corrosives area. Store in a cool, dry area away from incompatible substances.
Handling:Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use only in a well ventilated area. Do not get in eyes, on skin, or on clothing. Do not ingest or inhale. Use only in a chemical fume hood. Discard contaminated shoes.