3-methyl-1-nitrobutan-2-one

Modify Date: 2025-10-04 19:23:09

3-methyl-1-nitrobutan-2-one Structure
3-methyl-1-nitrobutan-2-one structure
Common Name 3-methyl-1-nitrobutan-2-one
CAS Number 62087-36-9 Molecular Weight 131.13000
Density N/A Boiling Point N/A
Molecular Formula C5H9NO3 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 3-methyl-1-nitrobutan-2-one
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C5H9NO3
Molecular Weight 131.13000
Exact Mass 131.05800
PSA 62.89000
LogP 1.01140
InChIKey YGMPYRLXLZLYPR-UHFFFAOYSA-N
SMILES CC(C)C(=O)C[N+](=O)[O-]

 Synthetic Route

~87%

3-methyl-1-nitrobutan-2-one Structure

3-methyl-1-nitr...

CAS#:62087-36-9

Literature: Pascual, Alfons Helvetica Chimica Acta, 1991 , vol. 74, # 3 p. 531 - 542

 Synonyms

2-Butanone,3-methyl-1-nitro
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