AG000B4B

114335-54-5 | 3-Pyridinol, 2-amino-4-bromo-

AG000B4B

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CAS Number	114335-54-5
Catalog Number	AG000B4B(AGN-PC-03BKAJ)
Chemical Name	3-Pyridinol, 2-amino-4-bromo-
IUPAC Name	2-amino-4-bromopyridin-3-ol
InChI	InChI=1S/C5H5BrN2O/c6-3-1-2-8-5(7)4(3)9/h1-2,9H,(H2,7,8)
InChI Key	VHVGFRZWGORWHX-UHFFFAOYSA-N
MDL Number	MFCD16658903
Molecular Formula	C5H5BrN2O
Molecular Weight	189.0100
SMILES	NC1=NC=CC(=C1O)Br
Synonyms	2-Amino-4-bromopyridin-3-ol, 114335-54-5, 2-amino-3-hydroxy-4-bromopyridine, 2-amino-4-bromo-3-pyridinol, SCHEMBL2590367, 2-amino-4 -bromo-3-pyridinol, CTK8B7345, DTXSID60613857, 3-Pyridinol, 2-amino-4-bromo-, VHVGFRZWGORWHX-UHFFFAOYSA-N, 2-Amino-4-bromo-3-hydroxypyridine, 2374AA, ANW-57090, STL476669, ZINC21981839, AKOS016002731, SB10526, DB-060605, TC-145835, FT-0754094, C5H5BrN2O,

Complexity	101
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.959g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	189.012g/mol
Monoisotopic Mass	187.959g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	59.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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