4-Methyl-3-oximino-2-pentanone

HCID 6795112
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Basic information

CAS
5440-21-1
Standard SMILES
CC(=O)C(=NO)C(C)C
InChIKey
KKWRXTVMYYRSMZ-UHFFFAOYSA-N
Molecular formula
C6H11NO2
Average molar mass
129.16 g/mol
Monoisotopic mass
129.07897859

Names & identifiers

Preferred name
4-Methyl-3-oximino-2-pentanone
IUPAC
3-hydroxyimino-4-methylpentan-2-one

Names & synonyms

4-Methyl-2,3-pentanedione 3-oxime3-(hydroxyimino)-4-methylpentan-2-one5440-21-1SCHEMBL94872534-methyl-3-oximino-2-pentanone4-methyl-3-oximinopentan-2-oneKKWRXTVMYYRSMZ-UHFFFAOYSA-NDTXSID8013002152-Pentanone, 3-hydroxyimino-4-methyl-

Database identifiers

CAS
5440-21-1
PubChem CID
6795112
DTXSID
DTXSID801300215

Properties

Computed structural propertiesFilling in

XLogP
1.4
Topological polar surface area
49.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
9

Related reactions

11 records
New reaction record

Compound notes

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