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N-[2-(Methylsulfanyl)phenyl]nonanamide

HCID 12376651
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Basic information

CAS
65655-69-8
Standard SMILES
CCCCCCCCC(=O)Nc1ccccc1SC
InChIKey
ATSSZYITBCIBEO-UHFFFAOYSA-N
Molecular formula
C16H25NOS
Average molar mass
279.4 g/mol
Monoisotopic mass
279.16568559

Names & identifiers

Preferred name
N-[2-(Methylsulfanyl)phenyl]nonanamide
IUPAC
N-(2-methylsulfanylphenyl)nonanamide

Names & synonyms

65655-69-8N-[2-(METHYLSULFANYL)PHENYL]NONANAMIDEDTXSID30495147

Database identifiers

CAS
65655-69-8
PubChem CID
12376651
DTXSID
DTXSID30495147

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
54.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
9
Heavy atoms
19
Formal charge
0
Complexity
245

Related reactions

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Compound notes

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