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4-[(4-chlorophenyl)sulfanyl]aniline

4-[(4-chlorophenyl)sulfanyl]aniline

CAS: 32631-29-1

Formula: C12H10ClNS

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

IUPAC: 4-[(4-chlorophenyl)sulfanyl]aniline

InChI: InChI=1S/C12H10ClNS/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,14H2

Composition: C (61.14%), H (4.28%), Cl (15.04%), N (5.94%), S (13.60%)

Molar Mass: 235.73

Atom Count: 25

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 235.0222482
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey DVTZWUZZYSGZLE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.25
Topological Polar Surface Area 26.02
Polarizability 25.96
Ring Count 2
Rotatable Bond Count 2

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