2,3-Dichloroisonicotinic acid

CAT: 0024-sc-265963Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-265963Size:1 g

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CAS Number

184416-84-0

Chemical Information

2,3-Dichloropyridine-4-carboxylic acid

CAS Number	184416-84-0
PubChem CID	2736083
IUPAC Name	2,3-dichloropyridine-4-carboxylic acid
Molecular Formula	C6H3Cl2NO2
Molecular Weight	192.00
XLogP	2
Topological Polar Surface Area	50.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	165

SMILES

C1=CN=C(C(=C1C(=O)O)Cl)Cl

InChI

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

InChIKey

VGKZZKKTZKRCPA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 184416-84-0

CID: 2736083

Formula: C6H3Cl2NO2

MW: 192.00

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	192.00
XLogP3	2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	190.9540837
Monoisotopic Mass	190.9540837
Topological Polar Surface Area	50.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	165
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-479878	3-Amino-2,6-dichloroisonicotinic Acid
sc-274378	2-Bromo-3,5-dichloroisonicotinic acid
sc-260165A	2,2,3,3-Tetrafluoropropionic acid
sc-225566	2,2,3,3-Tetramethylcyclopropanecarboxylic acid
sc-343340A	2,2,3,3-tetrafluorocyclobutanecarboxylic acid
sc-343340	2,2,3,3-tetrafluorocyclobutanecarboxylic acid
sc-260165	2,2,3,3-Tetrafluoropropionic acid
sc-266007	2,3,3-Trichloroacrylic acid
sc-266007A	2,3,3-Trichloroacrylic acid
sc-260205A	2,3,3,3-Tetrafluoropropanoic acid

Catalog	Name
OR2859-01	2,3-Dichloroisonicotinic acid
427339-01	3,5-Dichloroisonicotinic acid
Fr12734	2,6-Dichloroisonicotinic acid
420529-01	2,5-Dichloroisonicotinic acid
TRC-A604775-2.5G	3-Amino-2,6-dichloroisonicotinic Acid
OR16993-01	2-Bromo-3,5-dichloroisonicotinic acid
OR1089799-01	3-Bromo-2,6-dichloroisonicotinic acid
230964-01	2,5-Dichloroisonicotinic acid ≥95% (HPLC)
FBA40741-01	2,2,3,3-Tetramethylbutanoic acid
159807	2,2,3,3-Tetramethylcyclopropanecarboxylic Acid