5-bromo-2-methylphenol

5-bromo-2-methylphenol

CAS: 36138-76-8

Formula: C7H7BrO

SMILES: CC1=C(O)C=C(Br)C=C1

IUPAC: 5-bromo-2-methylphenol

InChI: InChI=1S/C7H7BrO/c1-5-2-3-6(8)4-7(5)9/h2-4,9H,1H3

Composition: C (44.95%), H (3.77%), Br (42.72%), O (8.55%)

Molar Mass: 187.036

Atom Count: 16

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	185.968028
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	OONJCAWRVJDVBB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.7
Topological Polar Surface Area	20.23
Polarizability	15.52
Ring Count	1
Rotatable Bond Count	0

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