AG000JBT

1227578-74-6 | 3-Pyridinol, 2-bromo-4-methyl-

AG000JBT

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CAS Number	1227578-74-6
Catalog Number	AG000JBT(AGN-PC-0WAN3P)
Chemical Name	3-Pyridinol, 2-bromo-4-methyl-
IUPAC Name	2-bromo-4-methylpyridin-3-ol
InChI	InChI=1S/C6H6BrNO/c1-4-2-3-8-6(7)5(4)9/h2-3,9H,1H3
InChI Key	TYLUWWMFDQJTRR-UHFFFAOYSA-N
MDL Number	MFCD11110697
Molecular Formula	C6H6BrNO
Molecular Weight	188.0219
SMILES	OC1=C(C)C=CN=C1Br
Synonyms	2-Bromo-4-methylpyridin-3-ol, 1227578-74-6, AK137324, 2-Bromo-3-hydroxy-4-methylpyridine, 2-Bromo-3-hydroxy-4-picoline, SCHEMBL6574587, KS-00000RPV, DTXSID50660577, 3-Pyridinol, 2-bromo-4-methyl-, FCH889093, MFCD11110697, ZINC40118255, AKOS006305868, DS-5827, QC-8881, AJ-101578, AX8258892, ST2404213, 4CH-018813,

Complexity	99.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.963g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	188.024g/mol
Monoisotopic Mass	186.963g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	33.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number