AG004KPU

871239-58-6 | 2-(5-Bromopyridin-2-yl)-2-methylpropanenitrile

AG004KPU

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CAS Number	871239-58-6
Catalog Number	AG004KPU(AGN-PC-00C4UN)
Chemical Name	2-(5-Bromopyridin-2-yl)-2-methylpropanenitrile
IUPAC Name	2-(5-bromopyridin-2-yl)-2-methylpropanenitrile
InChI	InChI=1S/C9H9BrN2/c1-9(2,6-11)8-4-3-7(10)5-12-8/h3-5H,1-2H3
InChI Key	LCFRTRIRICENNR-UHFFFAOYSA-N
MDL Number	MFCD08166395
Molecular Formula	C9H9BrN2
Molecular Weight	225.0852
SMILES	CC(C)(C1=NC=C(Br)C=C1)C#N
Synonyms	2-(5-Bromopyridin-2-yl)-2-methylpropanenitrile, 871239-58-6, KSC496Q4N, SCHEMBL1403854, CTK3J6846, DTXSID90468998, LCFRTRIRICENNR-UHFFFAOYSA-N, KS-000011HH, 3755AC, ANW-61310, MFCD08166395, ZINC26896171, AKOS016003358, FCH1386416, AJ-83002, AK-48883, AS-41355, BBV-40262523, CJ-17602, QC-10247, SC-28244, AB0049625, AX8212883, DB-024688, RT-003308, FT-0761822, ST24039491, 2-(5-Bromopyridin-2-yl)-2-methylpropionitrile, B65269, X-2995, 2-Methyl-2-(5-bromo-2-pyridinyl)propanenitrile, 2-(5-Bromo-pyridin-2-yl)-2-methyl-propionitrile, 2-Pyridineacetonitrile, 5-bromo-alpha,alpha-dimethyl-, 2-(5-Bromopyridin-2-yl)-2-methylpropanenitrile, 99%, C9H9BrN2, CID11586622, 2-(5-bromopyridin-2-yl)-2-methyl-propanenitrile,

Complexity	204
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.995g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	225.089g/mol
Monoisotopic Mass	223.995g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	36.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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