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clopyralid

clopyralid

CAS: 1702-17-6

Formula: C6H3Cl2NO2

SMILES: OC(=O)C1=C(Cl)C=CC(Cl)=N1

IUPAC: 3,6-dichloropyridine-2-carboxylic acid

InChI: InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)

Composition: C (37.54%), H (1.58%), Cl (36.93%), N (7.30%), O (16.67%)

Molar Mass: 192

Atom Count: 14

Heavy Atom Count: 11

Properties
Properties
Common Names acide 3,6-dichloropicolinique; acide dichloro-3,6 picolinique; clopyralid
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 190.9540837
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey HUBANNPOLNYSAD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.46
Topological Polar Surface Area 50.19
Polarizability 15.81
Ring Count 1
Rotatable Bond Count 1

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