AG00F1FV

58052-48-5 | PYRIDOXAMINE DIHYDROCHLORIDE

AG00F1FV

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CAS Number	58052-48-5
Catalog Number	AG00F1FV(AGN-PC-0WQUOB)
Chemical Name	PYRIDOXAMINE DIHYDROCHLORIDE
IUPAC Name	4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol;hydrate;dihydrochloride
InChI	InChI=1S/C8H12N2O2.2ClH.H2O/c1-5-8(12)7(2-9)6(4-11)3-10-5;;;/h3,11-12H,2,4,9H2,1H3;2*1H;1H2
InChI Key	UUEYKKGETIFWDR-UHFFFAOYSA-N
MDL Number	MFCD00012808
Molecular Formula	C8H16Cl2N2O3
Molecular Weight	259.1302
SMILES	NCC1=C(C=NC(C)=C1O)CO.[H]Cl.[H]Cl.[H]O[H]
Synonyms	pyridoxamine dihydrochloride monohydrate, 58052-48-5, C8H12N2O2.2HCl.H2O, 7923AF, MFCD00150098, PYRIDOXAMINE DIHYDROCHLORIDE, CS-O-30731, 524-36-7,

Complexity	143
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	258.054g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	6
Isotope Atom Count	0
Molecular Weight	259.127g/mol
Monoisotopic Mass	258.054g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	80.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
UN Code

Certificate of Analysis

Lot Number