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N-{4-[(4-methylphenyl)sulfanyl]phenyl}acetamide

N-{4-[(4-methylphenyl)sulfanyl]phenyl}acetamide

CAS: 339096-10-5

Formula: C15H15NOS

SMILES: CC(=O)NC1=CC=C(SC2=CC=C(C)C=C2)C=C1

IUPAC: N-{4-[(4-methylphenyl)sulfanyl]phenyl}acetamide

InChI: InChI=1S/C15H15NOS/c1-11-3-7-14(8-4-11)18-15-9-5-13(6-10-15)16-12(2)17/h3-10H,1-2H3,(H,16,17)

Composition: C (70.01%), H (5.88%), N (5.44%), O (6.22%), S (12.46%)

Molar Mass: 257.35

Atom Count: 33

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 257.087435281
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey PMAHLXRQZPRIGL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 78.65
Topological Polar Surface Area 29.1
Polarizability 29.62
Ring Count 2
Rotatable Bond Count 3

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90% <2 Days 339096-10-5 $51.35-$86.31$51.35$63.37$86.31
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