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2,4,4-Trimethyl-6,8-nonadien-3-one oxime

HCID 3020009
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Basic information

CAS
84625-53-6
Standard SMILES
C=CC=CCC(C)(C)C(=NO)C(C)C
InChIKey
JZVFMABEZCKLSU-UHFFFAOYSA-N
Molecular formula
C12H21NO
Average molar mass
195.3 g/mol
Monoisotopic mass
195.16231429

Names & identifiers

Preferred name
2,4,4-Trimethyl-6,8-nonadien-3-one oxime
IUPAC
N-(2,4,4-trimethylnona-6,8-dien-3-ylidene)hydroxylamine

Names & synonyms

DTXSID5012771722,4,4-Trimethyl-6,8-nonadien-3-one oximeNS00059630N-(2,4,4-trimethylnona-6,8-dien-3-ylidene)hydroxylamine

Database identifiers

CAS
84625-53-6
PubChem CID
3020009
DTXSID
DTXSID501277172

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
32.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
14
Formal charge
0
Complexity
237

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Compound notes

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