2-chloro-2-fluorocyclopropane-1-carboxylic acid

2-chloro-2-fluorocyclopropane-1-carboxylic acid

CAS: 137081-42-6

Formula: C4H4ClFO2

SMILES: OC(=O)C1CC1(F)Cl

IUPAC: 2-chloro-2-fluorocyclopropane-1-carboxylic acid

InChI: InChI=1/C4H4ClFO2/c5-4(6)1-2(4)3(7)8/h2H,1H2,(H,7,8)

Composition: C (34.68%), H (2.91%), Cl (25.59%), F (13.72%), O (23.10%)

Molar Mass: 138.52

Atom Count: 12

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	137.9883852
Formal Charge	0
FSP3	0.75
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FOAOSDYEDASXTN-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	25.29
Topological Polar Surface Area	37.3
Polarizability	9.83
Ring Count	1
Rotatable Bond Count	1

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