Isoamyl isovalerate

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Names

[ CAS No. ]:
659-70-1

[ Name ]:
Isoamyl isovalerate

[Synonym ]:
Isoamyl 3-methylbutanoate
isopentyl isovalerate
Isopentyl 3-methylbutanoate
EINECS 201-730-4
3-methylbutyl isovalerate
Isovaleric acid, isopentyl ester
Butanoic acid, 3-methyl-, 3-methylbutyl ester
3-Methylbutyl 3-methylbutanoate
Isoamyl isopentanoate
Isoamyl 3-methylbutyrate
UNII-16M1VA1FJY
3-Methylbutyl 3-methylbutyrate
Isoamyl valerianate
Isopentyl 3-methylbutyrate
Isopentyl alcohol, isovalerate
isopentyl isopentanoate
MFCD00048369

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
194.0±0.0 °C at 760 mmHg

[ Molecular Formula ]:
C10H20O2

[ Molecular Weight ]:
172.265

[ Flash Point ]:
66.7±0.0 °C

[ Exact Mass ]:
172.146332

[ PSA ]:
26.30000

[ LogP ]:
3.53

[ Vapour Pressure ]:
0.5±0.3 mmHg at 25°C

[ Index of Refraction ]:
1.420

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NY1508000
CHEMICAL NAME :
Isovaleric acid, isopentyl ester
CAS REGISTRY NUMBER :
659-70-1
BEILSTEIN REFERENCE NO. :
1753884
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C10-H20-O2
MOLECULAR WEIGHT :
172.30
WISWESSER LINE NOTATION :
1Y1&2OV1Y1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 16,789,1978 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
13956 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IMSUAI Industrial Medicine and Surgery. (Northbrook, IL) V.18-42, 1949-73. For publisher information, see IOHSA5. Volume(issue)/page/year: 41,31,1972 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - T1892 No. of Facilities: 324 (estimated) No. of Industries: 4 No. of Occupations: 8 No. of Employees: 14007 (estimated) No. of Female Employees: 11916 (estimated)

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xi:Irritant

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36/37/39

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
NY1508000

[ HS Code ]:
2915900090

Synthetic Route

Precursor & DownStream

Precursor

  • 3-Methyl-1-butanol
  • Methanol
  • t-Butyl hypochlorite
  • Isoamyl ether
  • 3-Methylbutanoic acid
  • DL-Leucic Acid
  • Sulfuric acid
  • Water
  • Isopentyl nitrite
  • Ethanol

DownStream

  • Isoamyl ether
  • 3-Methylbutanoic acid
  • isopentyl-phenyl selenide
  • Isoamyl bromide

Customs

[ 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%

Articles

Mosciano, G.

Perfum. Flavor. 4th ed., 24 , 28, (1999)


More Articles


Related Compounds

  • Isoamyl N-butyrate
  • isoamyl 3-(2-furan)propionate
  • Isoamyl disulfide
  • isoamyl methyl methylphosphonate
  • Isoamyl 2-Octynoate
  • isoamyl tiglate
  • Methyl 4-((3-(hydroxymethyl)piperidin-1-yl)methyl)benzoate
  • 1-[4-[3-[[(4-Fluorophenyl)methyl](2-furanylmethyl)amino]-2-hydroxypropoxy]phenyl]ethanone
  • [4-(1,3-Thiazol-4-yl)phenyl]methanamine
  • 4-Amino-4'-(trifluoromethyl)-3-biphenylcarbonitrile
  • {4-[2-(Pyridin-4-yl)-1,3-thiazol-4-yl]phenyl}methanamine
  • 1,1-Dimethylethyl N-[(1S)-1-formyl-2-(3-pyridinyl)ethyl]carbamate
  • 4-Methoxy-2-nitrophenyl 4-methylbenzene-1-sulfonate
  • 5-Bromo-3-hydroxyanthranilic acid
  • 3-Hydroxy-2-(methylamino)benzoic acid
  • 2-oxo-2-{4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}ethyl 3,4,5,6-tetrachloropyridine-2-carboxylate
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