2-chloropropanoic acid

2-chloropropanoic acid

CAS: 598-78-7

Formula: C3H5ClO2

SMILES: CC(Cl)C(O)=O

IUPAC: 2-chloropropanoic acid

InChI: InChI=1/C3H5ClO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6)

Composition: C (33.20%), H (4.64%), Cl (32.67%), O (29.49%)

Molar Mass: 108.52

Atom Count: 11

Heavy Atom Count: 6

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	107.9978071
Formal Charge	0
FSP3	0.67
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	GAWAYYRQGQZKCR-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	21.89
Topological Polar Surface Area	37.3
Polarizability	8.78
Ring Count	0
Rotatable Bond Count	1

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