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1-chloro-3-(methylsulfanyl)benzene

1-chloro-3-(methylsulfanyl)benzene

CAS: 4867-37-2

Formula: C7H7ClS

SMILES: CSC1=CC=CC(Cl)=C1

IUPAC: 1-chloro-3-(methylsulfanyl)benzene

InChI: InChI=1S/C7H7ClS/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3

Composition: C (53.00%), H (4.45%), Cl (22.35%), S (20.21%)

Molar Mass: 158.64

Atom Count: 16

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 157.9956991
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey PTGSDZVASWKUHK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.62
Topological Polar Surface Area 0
Polarizability 17.07
Ring Count 1
Rotatable Bond Count 1

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