ChemicalBook--->CAS DataBase List--->108-12-3

108-12-3

108-12-3 Structure

108-12-3 Structure
IdentificationMore
[Name]

Isovaleryl chloride
[CAS]

108-12-3
[Synonyms]

3-METHYLBUTYRYL CHLORIDE
AKOS BBS-00003911
ISOPENTANOYL CHLORIDE
ISOVALEROYL CHLORIDE
ISOVALERYL CHLORIDE
POLYOXYETHYLENE SORBITAN TRIOLEATE
3-Methylbutanoyl chloride
3-methyl-butanoylchlorid
Isovaleric acid chloride
Isovaleric chloride
Butanoyl chloride, 3-methyl-
Isopentanoyl chloride~3-Methylbutyryl chloride
ISOVALERYL CHLORIDE 98%
3-Methylbutanoic acid chloride
[EINECS(EC#)]

203-552-2
[Molecular Formula]

C5H9ClO
[MDL Number]

MFCD00000738
[Molecular Weight]

120.58
[MOL File]

108-12-3.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR COLOURLESS TO SLIGHTLY YELLOW OR PINK LIQUID
[Boiling point ]

115-117 °C (lit.)
[density ]

0.989 g/mL at 25 °C(lit.)
[vapor pressure ]

20.3hPa at 20℃
[refractive index ]

n20/D 1.416(lit.)
[Fp ]

66 °F
[storage temp. ]

Flammables area
[solubility ]

Chloroform (Soluble), Methanol (Slightly)
[form ]

Liquid
[color ]

Clear colorless to slightly yellow or pink
[Water Solubility ]

decomposes
[Sensitive ]

Moisture Sensitive
[Merck ]

14,5232
[BRN ]

741910
[Stability:]

Moisture Sensitive
[InChI]

1S/C5H9ClO/c1-4(2)3-5(6)7/h4H,3H2,1-2H3
[InChIKey]

ISULZYQDGYXDFW-UHFFFAOYSA-N
[SMILES]

CC(C)CC(Cl)=O
[CAS DataBase Reference]

108-12-3(CAS DataBase Reference)
[NIST Chemistry Reference]

Butanoyl chloride, 3-methyl-(108-12-3)
[EPA Substance Registry System]

108-12-3(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Corrosion (GHS05)Skull and Crossbones (GHS06)
GHS02,GHS05,GHS06
[Signal word ]

Danger
[Hazard statements ]

H226-H314-H331
[Precautionary statements ]

P210-P233-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
[Hazard Codes ]

C,F
[Risk Statements ]

R10:Flammable.
R34:Causes burns.
R37:Irritating to the respiratory system.
R11:Highly Flammable.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S9:Keep container in a well-ventilated place .
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S16:Keep away from sources of ignition-No smoking .
[RIDADR ]

UN 2502 8/PG 2
[WGK Germany ]

3
[F ]

21
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29159080
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Acute Tox. 3 Inhalation
Flam. Liq. 3
Skin Corr. 1B
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

Fenvalerate-->brofluthrinate-->Tau-fluvalinate-->S-Methyl isovalerate-->N-AMYL ISOVALERATE-->Menthyl isovalerate-->GERANYL ISOVALERATE-->ISOVALERIC ANHYDRIDE-->Isopropylmalonic acid-->N-ISOVALERYLGLYCINE-->Butyl isovalerate-->1-(1-cyclohexen-1-yl)-3-methylbutan-1-one-->2-Oxazolidinone, 3-(3-methyl-1-oxobutyl)--->1-(2,5-dimethoxyphenyl)-3-methylbutan-1-one
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Isovaleryl chloride(108-12-3).msds
Hazard InformationBack Directory
[Chemical Properties]

CLEAR COLOURLESS TO SLIGHTLY YELLOW OR PINK LIQUID
[Uses]

Isovaleryl chloride was used in the synthesis of:
  • furanodictines A and B
  • tetrapeptide amide, S-benzyl-L-cysteinyl-L-prolyl-L-leucylglycinamide
  • (+)-blastmycinone
  • (R)- and (S)-2-methyl-4-octanol, aggregation pheromone of some sugarcane weevils
[Synthesis Reference(s)]

Journal of the American Chemical Society, 69, p. 2917, 1947 DOI: 10.1021/ja01203a514
[Flammability and Explosibility]

Highlyflammable
Spectrum DetailBack Directory
[Spectrum Detail]

Isovaleryl chloride(108-12-3)MS
Isovaleryl chloride(108-12-3)1HNMR
Isovaleryl chloride(108-12-3)13CNMR
Isovaleryl chloride(108-12-3)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Isovaleryl chloride, 98%(108-12-3)
[Alfa Aesar]

Isovaleryl chloride, 98%(108-12-3)
[Sigma Aldrich]

108-12-3(sigmaaldrich)
[TCI AMERICA]

Isovaleryl Chloride,>99.0%(T)(108-12-3)
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