4-bromo-1-methyl-2-(methylsulfanyl)benzene

4-bromo-1-methyl-2-(methylsulfanyl)benzene

CAS: 142994-01-2

Formula: C8H9BrS

SMILES: CSC1=CC(Br)=CC=C1C

IUPAC: 4-bromo-1-methyl-2-(methylsulfanyl)benzene

InChI: InChI=1S/C8H9BrS/c1-6-3-4-7(9)5-8(6)10-2/h3-5H,1-2H3

Composition: C (44.25%), H (4.18%), Br (36.80%), S (14.77%)

Molar Mass: 217.12

Atom Count: 19

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	215.960834
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	BTJYDFNXIOKYJM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.48
Topological Polar Surface Area	0
Polarizability	19.7
Ring Count	1
Rotatable Bond Count	1

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