AG000LIO

1240621-87-7 | 5-Pyrimidinol, 2-bromo-

AG000LIO

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CAS Number	1240621-87-7
Catalog Number	AG000LIO(AGN-PC-07ZXDA)
Chemical Name	5-Pyrimidinol, 2-bromo-
IUPAC Name	2-bromopyrimidin-5-ol
InChI	InChI=1S/C4H3BrN2O/c5-4-6-1-3(8)2-7-4/h1-2,8H
InChI Key	QHUDDDWGZQPDIC-UHFFFAOYSA-N
MDL Number	MFCD09953508
Molecular Formula	C4H3BrN2O
Molecular Weight	174.9834
SMILES	OC1=CN=C(Br)N=C1
Synonyms	2-bromopyrimidin-5-ol, 1240621-87-7, 2-BROMO-5-HYDROXYPYRIMIDINE, 5-Pyrimidinol, 2-bromo-, SCHEMBL457025, 2-BROMO-5-PYRIMIDINOL, CTK8D3763, DTXSID50676936, QHUDDDWGZQPDIC-UHFFFAOYSA-N, KS-000006MP, 5494AJ, MFCD09953508, ZINC66327947, AKOS015892486, PB31459, RL01097, TRA0169494, DS-17373, SY024555, AB0047396, AJ-116104, ST1140974, TC-072091, 4CH-004562, CS-0043736, Q-3165, MFCD09953508 (95+%), I03-0558, J-508545, S03-0148, C4H3BrN2O, 10361-43-0,

Complexity	72.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.943g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	174.985g/mol
Monoisotopic Mass	173.943g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	46A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number