AG00144X

1379335-87-1 | 2-Pyridinecarbonitrile, 6-bromo-3-methyl-

AG00144X

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CAS Number	1379335-87-1
Catalog Number	AG00144X(AGN-PC-0WAKH9)
Chemical Name	2-Pyridinecarbonitrile, 6-bromo-3-methyl-
IUPAC Name	6-bromo-3-methylpyridine-2-carbonitrile
InChI	InChI=1S/C7H5BrN2/c1-5-2-3-7(8)10-6(5)4-9/h2-3H,1H3
InChI Key	FGVHKABWIDIKRG-UHFFFAOYSA-N
MDL Number	MFCD19707627
Molecular Formula	C7H5BrN2
Molecular Weight	197.0320
SMILES	N#CC1=NC(Br)=CC=C1C
Synonyms	6-Bromo-3-methylpicolinonitrile, 1379335-87-1, 6-bromo-3-methylpyridine-2-carbonitrile, 6-Bromo-3-methyl-2-pyridinecarbonitrile, DTXSID00856867, MFCD19707627, ZINC88190102, AKOS022173860, FCH1315626, NE33570, AS-42697, BBV-40026993, 2-Pyridinecarbonitrile, 6-bromo-3-methyl-, AJ-128172, AX8259891, EN300-160352,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	195.964g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	197.035g/mol
Monoisotopic Mass	195.964g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	36.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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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