1-Methylthio-3,3-dimethyl-2-butanone oxime

HCID 38232
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Basic information

CAS
39195-82-9
Standard SMILES
CSCC(=NO)C(C)(C)C
InChIKey
WMNXDZQBHMQKLX-UHFFFAOYSA-N
Molecular formula
C7H15NOS
Average molar mass
161.27 g/mol
Monoisotopic mass
161.08743528

Names & identifiers

Preferred name
1-Methylthio-3,3-dimethyl-2-butanone oxime
IUPAC
N-(3,3-dimethyl-1-methylsulfanylbutan-2-ylidene)hydroxylamine

Names & synonyms

N-(3,3-dimethyl-1-methylsulfanylbutan-2-ylidene)hydroxylamineSCHEMBL109988771-methylthio-3,3-dimethyl-2-butanone oximeNS00057854N-[3,3-dimethyl-1-(methylsulfanyl)butan-2-ylidene]hydroxylamine

Database identifiers

CAS
39195-82-9
PubChem CID
38232
DTXSID
DTXSID3052066

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
57.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
10

Related reactions

11 records
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Compound notes

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