AG00348E

35590-37-5 | 5-Bromonicotinonitrile

AG00348E

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CAS Number	35590-37-5
Catalog Number	AG00348E(AGN-PC-0JVOJF)
Chemical Name	5-Bromonicotinonitrile
IUPAC Name	5-bromopyridine-3-carbonitrile
InChI	InChI=1S/C6H3BrN2/c7-6-1-5(2-8)3-9-4-6/h1,3-4H
InChI Key	FTFFHWWIPOQCBC-UHFFFAOYSA-N
MDL Number	MFCD00174363
Molecular Formula	C6H3BrN2
Molecular Weight	183.0054
SMILES	N#Cc1cncc(c1)Br
Synonyms	5-bromonicotinonitrile, 35590-37-5, 5-bromopyridine-3-carbonitrile, 3-Bromo-5-cyanopyridine, 5-Bromo-3-cyanopyridine, 3-cyano-5-bromopyridine, 3-Pyridinecarbonitrile, 5-bromo-, MFCD00174363, 3-bromo-5-cyano-pyridine, 5-Bromo-3-cyanopyridine, 97%, 5-BROMO-3-PYRIDINECARBONITRILE, PubChem7702, AC1LEIWU, ACMC-209ihz, AC1Q25BR, AC1Q4RJ1, KSC492G7P, SCHEMBL248926, Jsp006399, CTK3J2377, DTXSID80353102, FTFFHWWIPOQCBC-UHFFFAOYSA-N, ZINC161484, ABBYPHARMA AP-17-5584, ACN-S003275, ALBB-005237, EBD38063, KS-000000YG, ANW-28245, CB-514, CCG-43357, SBB040176, STK503304, AKOS000268637, AC-3513, CS-W002478, FS-1107, MCULE-1361703817, PB14142, QC-2764, RP03293, RTR-014708, TRA0084858, AJ-15752, AK-23819, AN-12913, BC003269, BP-12631, BR-23819, CJ-01973, SC-45900, SY007685, ZB007594, AB0011692, DB-009951, ST2418691, TR-014708, 4CH-013244, AM20070018, B3713, FT-0620168, ST50213312, C-5717, 14644-EP2295437A1, 14644-EP2298775A1, 14644-EP2316836A1, MFCD00174363 (97+%), 113227-EP2295437A1, 113227-EP2298775A1, 113353-EP2295437A1, 113353-EP2298775A1, 113398-EP2295437A1, 113398-EP2298775A1, 590B375, AC-907/30003048, I02-0468, SR-01000633285-1, W-202465, F2124-0063, 5-bromo-nicotinonitrile, 2-cyano-5-bromopyridine, C6H3BrN2, AR-1G7533, CID736793, RW1628, ZINC00161484, ACN-028189, 5-Bromo-3-cyanopyridine, 98% - 1G 1g, 35779-43-2,

Complexity	137
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.948g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	183.008g/mol
Monoisotopic Mass	181.948g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	36.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number