1-(3-bromo-2-hydroxy-5-methylphenyl)propan-1-one

1-(3-bromo-2-hydroxy-5-methylphenyl)propan-1-one

CAS: 2892-30-0

Formula: C10H11BrO2

SMILES: CCC(=O)C1=C(O)C(Br)=CC(C)=C1

IUPAC: 1-(3-bromo-2-hydroxy-5-methylphenyl)propan-1-one

InChI: InChI=1S/C10H11BrO2/c1-3-9(12)7-4-6(2)5-8(11)10(7)13/h4-5,13H,3H2,1-2H3

Composition: C (49.41%), H (4.56%), Br (32.87%), O (13.16%)

Molar Mass: 243.1

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	241.994243
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	YEUFMIWSNYNQFS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.73
Topological Polar Surface Area	37.3
Polarizability	21.11
Ring Count	1
Rotatable Bond Count	2

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