Pralidoxime Impurity 2

CAT: 1299-RM-P223002-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-P223002-02Size:25 mg

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CAS Number

3697-38-9

Synonyms

2-carboxy-1-methylpyridin-1-ium chloride

Molecular Formula

C7H8ClNO2

Molecular Weight

173.6

Target Alternative Name

Pralidoxime

Product Name Synonym

2-carboxy-1-methylpyridin-1-ium chloride

Chemical Information

Homarine hydrochloride

CAS Number	3697-38-9
PubChem CID	13645641
IUPAC Name	1-methylpyridin-1-ium-2-carboxylic acid chloride
Molecular Formula	C7H8ClNO2
Molecular Weight	173.60
Topological Polar Surface Area	41.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	136

SMILES

C[N+]1=CC=CC=C1C(=O)O.[Cl-]

InChI

InChI=1S/C7H7NO2.ClH/c1-8-5-3-2-4-6(8)7(9)10;/h2-5H,1H3;1H

InChIKey

WIPNUQPJVZZAOG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3697-38-9

CID: 13645641

Formula: C7H8ClNO2

MW: 173.60

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	173.60
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	173.0243562
Monoisotopic Mass	173.0243562
Topological Polar Surface Area	41.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	136
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	2
Compound Is Canonicalized	Yes

Catalog	Name
RM-P223003-01	Pralidoxime Impurity 3
RM-P223004-01	Pralidoxime Impurity 4
RM-P223007-01	Pralidoxime Impurity 7
RM-P223001-01	Pralidoxime Impurity 1
RM-P223006-01	Pralidoxime Impurity 6
RM-P223005-01	Pralidoxime Impurity 5
RM-P223000-01	Pralidoxime Chloride
RM-G271002-01	Gc376 Impurity 2; Nirmatrelvir Impurity
RM-V192041-01	Valsartan Impurity 41; Sacubitril Impurity 2
RM-V192107-01	Valsartan Impurity 107; Amlodipine Impurity 2

Catalog	Name
HY-B1738	Pralidoxime
592128	Pralidoxime iodide
318556	Pralidoxime Chloride
MBS5813002	Pralidoxime mesylate
HY-B1738B	Pralidoxime (methanesulfonate)
HY-B1738A-01	Pralidoxime (iodide)
HY-B1200-01	Pralidoxime (chloride)