AG000JF1

1227601-75-3 | 4-Pyridinemethanol, 2-bromo-3-fluoro-

AG000JF1

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CAS Number	1227601-75-3
Catalog Number	AG000JF1(AGN-PC-0WAMCE)
Chemical Name	4-Pyridinemethanol, 2-bromo-3-fluoro-
IUPAC Name	(2-bromo-3-fluoropyridin-4-yl)methanol
InChI	InChI=1S/C6H5BrFNO/c7-6-5(8)4(3-10)1-2-9-6/h1-2,10H,3H2
InChI Key	PESRNDDYOHOPPV-UHFFFAOYSA-N
MDL Number	MFCD16606993
Molecular Formula	C6H5BrFNO
Molecular Weight	206.0124
SMILES	OCC1=C(F)C(Br)=NC=C1
Synonyms	(2-Bromo-3-fluoropyridin-4-yl)methanol, 1227601-75-3, AK174173, 2-Bromo-3-fluoro-4-(hydroxymethyl)pyridine, SCHEMBL20607540, 2-Bromo-3-fluoropyridine-4-methanol, MFCD16606993, ZINC95616310, AKOS025396404, DS-8613, FCH1343693, 4-Pyridinemethanol, 2-bromo-3-fluoro-, C-0422,

Complexity	114
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	204.954g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	206.014g/mol
Monoisotopic Mass	204.954g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	33.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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