1-(4-bromo-2-fluorophenyl)cyclopropane-1-carboxylic acid

1-(4-bromo-2-fluorophenyl)cyclopropane-1-carboxylic acid

CAS: 872422-15-6

Formula: C10H8BrFO2

SMILES: OC(=O)C1(CC1)C1=CC=C(Br)C=C1F

IUPAC: 1-(4-bromo-2-fluorophenyl)cyclopropane-1-carboxylic acid

InChI: InChI=1S/C10H8BrFO2/c11-6-1-2-7(8(12)5-6)10(3-4-10)9(13)14/h1-2,5H,3-4H2,(H,13,14)

Composition: C (46.36%), H (3.11%), Br (30.84%), F (7.33%), O (12.35%)

Molar Mass: 259.074

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	257.969171
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	UPADMCJEKQAEKT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.48
Topological Polar Surface Area	37.3
Polarizability	20.19
Ring Count	2
Rotatable Bond Count	2

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