2,5-dichloro-3-fluorobenzoic acid

2,5-dichloro-3-fluorobenzoic acid

CAS: 501008-42-0

Formula: C7H3Cl2FO2

SMILES: OC(=O)C1=CC(Cl)=CC(F)=C1Cl

IUPAC: 2,5-dichloro-3-fluorobenzoic acid

InChI: InChI=1S/C7H3Cl2FO2/c8-3-1-4(7(11)12)6(9)5(10)2-3/h1-2H,(H,11,12)

Composition: C (40.23%), H (1.45%), Cl (33.92%), F (9.09%), O (15.31%)

Molar Mass: 209

Atom Count: 15

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	207.9494129
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	ZVYNMBUXCNVMSC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.14
Topological Polar Surface Area	37.3
Polarizability	16.42
Ring Count	1
Rotatable Bond Count	1

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