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Isovaleryl chloride

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Isovaleryl chloride Basic information

Product Name:
Isovaleryl chloride
Synonyms:
  • 3-METHYLBUTYRYL CHLORIDE
  • AKOS BBS-00003911
  • ISOPENTANOYL CHLORIDE
  • ISOVALERYL CHLORIDE
  • ISOVALEROYL CHLORIDE
  • 3-Methylbutanoyl chloride
  • 3-methyl-butanoylchlorid
  • Isovaleric acid chloride
CAS:
108-12-3
MF:
C5H9ClO
MW:
120.58
EINECS:
203-552-2
Product Categories:
  • Acid Halides
  • Building Blocks
  • Carbonyl Compounds
  • Chemical Synthesis
  • Organic Building Blocks
  • Pharmaceutical intermediates
Mol File:
108-12-3.mol
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Isovaleryl chloride Chemical Properties

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.)
Flash point:
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
Butanoyl chloride, 3-methyl- (108-12-3)
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Safety Information

Hazard Codes 
C,F
Risk Statements 
10-34-37-11-20
Safety Statements 
26-36/37/39-45-9-23-16
RIDADR 
UN 2502 8/PG 2
WGK Germany 
3
21
TSCA 
TSCA listed
HazardClass 
8
PackingGroup 
II
HS Code 
29159080
Storage Class
3 - Flammable liquids
Hazard Classifications
Acute Tox. 3 Inhalation
Flam. Liq. 3
Skin Corr. 1B

MSDS

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Isovaleryl chloride Usage And Synthesis

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

Highly flammable

Isovaleryl chloride Preparation Products And Raw materials

Preparation Products

Isovaleryl chlorideSupplier

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