5,6-Dichloropicolinic acid

CAT: 0127-OR183419-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR183419-01Size:1 g

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CAS Number

88912-24-7

MDL Number

MFCD13185546

Purity

98%

Smiles

OC(=O)c1ccc(Cl)c(Cl)n1

Chemical Information

2-Pyridinecarboxylic acid, 5,6-dichloro-

CAS Number	88912-24-7
PubChem CID	13278016
IUPAC Name	5,6-dichloropyridine-2-carboxylic acid
Molecular Formula	C6H3Cl2NO2
Molecular Weight	192.00
XLogP	1.7
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=CC(=NC(=C1Cl)Cl)C(=O)O

InChI

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

InChIKey

QOJNAEPFSUYAFL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 88912-24-7

CID: 13278016

Formula: C6H3Cl2NO2

MW: 192.00

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	192.00
XLogP3	1.7
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
OR73589-01	3-Amino-4,6-dichloropicolinic acid
OR91712-01	4-Amino-3,6-dichloropicolinic acid
OR1909	5,6-Dichloronicotinic acid
OR1090682-01	5-bromo-2,6-dichloronicotinic acid
OR525672-01	5-Bromo-4,6-dichloronicotinic acid
OR12186-01	4,6-Dichloronicotinic acid
PC107697	5,5,6,6,6-Pentafluorohexanoic acid
OR1907-01	2,6-Dichloronicotinic acid
OR8270-01	4,5-Dichloronicotinic acid
OR3876-01	2,5-Dichloronicotinic acid

Catalog	Name
437155-01	5,6-Dichloropicolinic acid
sc-267817	4,6-Dichloropicolinic acid
RG-D090334-01	4,5-Dichloropicolinic Acid
JNB57803-01	3,4-Dichloropicolinic acid
H998457	Heptanoic-5,5,6,6-d4 Acid
MBS654193-01	5 (6) -Tetramethylrhodaminecarboxylic Acid
437367-01	5',6'-Epoxyeicosatrienoic acid
TRC-D435653-500MG	5,6-Dichloronicotinic acid
HY-W080797-01	4,4,5,5,6,6,6-Heptafluorohexanoic acid
437207-01	5,6-Dimethoxypicolinic acid