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97-61-0

97-61-0 structure
97-61-0 structure
  • Name: 2-Methylpentanoic acid
  • Chemical Name: 2-methylvaleric acid
  • CAS Number: 97-61-0
  • Molecular Formula: C6H12O2
  • Molecular Weight: 116.158
  • Catalog: Biochemical Amino acids and their derivatives Glycine derivatives
  • Create Date: 2018-06-02 08:00:00
  • Modify Date: 2024-01-02 18:06:50
  • 2-Methylvaleric acid (2-Methylpentanoic acid) is a short-chain fatty acid isolated from Campomanesia adamantium and dairy products. 2-Methylvaleric acid is also found in animal feces. 2-Methylvaleric acid is a flavor compound used for food-flavor ingredient, fragrances[1][2][3].

Name 2-methylvaleric acid
Synonyms 2-METHYL-N-VALERIC ACID
α-Methylvaleric acid
2-methyl pentanoic acid
2-METHYLPENTANOIC ACID FOR SYNTHESIS
methylvaleric acid
methylpentanoic acid
2-Methylvaleric acid
2-methylpentanoic
2-Methyl-valeric acid
Valeric acid, 2-methyl-
PENTANOIC ACID,2-METHYL-
Pentanoic acid, 2-methyl-
acidemethylvalerique
2-Methylvalerate
2-Methylpentanoic acid
2-Methylvalericacid
QVY3&1
2-METHYL VALERIC ACID
2-methyl-valericacid
EINECS 202-594-9
MFCD00002671
Density 0.9±0.1 g/cm3
Boiling Point 195.4±8.0 °C at 760 mmHg
Melting Point -85°C
Molecular Formula C6H12O2
Molecular Weight 116.158
Flash Point 91.1±0.0 °C
Exact Mass 116.083733
PSA 37.30000
LogP 1.66
Vapour Pressure 0.2±0.8 mmHg at 25°C
Index of Refraction 1.425

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YV7700000
CHEMICAL NAME :
Valeric acid, 2-methyl-
CAS REGISTRY NUMBER :
97-61-0
BEILSTEIN REFERENCE NO. :
1720655
LAST UPDATED :
199806
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C6-H12-O2
MOLECULAR WEIGHT :
116.18
WISWESSER LINE NOTATION :
QVY3&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Open irritation test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
UCDS** Union Carbide Data Sheet. (Union Carbide Corp., 39 Old Ridgebury Rd., Danbury, CT 06817) Volume(issue)/page/year: 2/4/1959
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,763,1982 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2040 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. (Chicago, IL) V.2-10, 1950-54. For publisher information, see AEHLAU. Volume(issue)/page/year: 10,61,1954
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
2500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,763,1982
Symbol GHS05
GHS05
Signal Word Danger
Hazard Statements H314
Precautionary Statements P280-P305 + P351 + P338-P310
Personal Protective Equipment Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes C:Corrosive;
Risk Phrases R34
Safety Phrases S26-S36/37/39-S45-S27
RIDADR UN 3265 8/PG 2
WGK Germany 3
RTECS YV7700000
Packaging Group III
Hazard Class 8
HS Code 2915900090
HS Code 2915900090
Summary 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%