AG0033X4

39186-58-8 | 4-Bromo-2,2-diphenylbutyronitrile

AG0033X4

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CAS Number	39186-58-8
Catalog Number	AG0033X4(AGN-PC-0RIVA9)
Chemical Name	4-Bromo-2,2-diphenylbutyronitrile
EC Number	254-337-5
IUPAC Name	4-bromo-2,2-diphenylbutanenitrile
InChI	InChI=1S/C16H14BrN/c17-12-11-16(13-18,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10H,11-12H2
InChI Key	IGYSFJHVFHNOEI-UHFFFAOYSA-N
MDL Number	MFCD00001845
Molecular Formula	C16H14BrN
Molecular Weight	300.1931
NSC Number	80688
SMILES	N#CC(c1ccccc1)(c2ccccc2)CCBr
Synonyms	4-Bromo-2,2-diphenylbutyronitrile, 39186-58-8, 4-Bromo-2,2-diphenylbutanenitrile, 2,2-Diphenyl-4-bromobutyronitrile, 4-bromo-2,2-diphenyl-butyronitrile, MFCD00001845, IGYSFJHVFHNOEI-UHFFFAOYSA-N, 3-Cyano-3,3-diphenylpropyl bromide, AK-47501, Benzeneacetonitrile, .alpha.-(2-bromoethyl)-.alpha.-phenyl-, NSC80688, EINECS 254-337-5, ACMC-1CSZA, AI3-28719, AC1L3WRC, Butyronitrile,2-diphenyl-, AC1Q27SK, AC1Q4QO8, KSC495I2R, ARONIS25014, SCHEMBL930701, bromoethyl diphenyl acetonitrile, Jsp006810, CTK3J5428, IGYSFJHVFHNOEI-UHFFFAOYSA-, 2,2-Diphenyl-4-brombutyronitril, DTXSID10192425, ZINC155164, 2,2-Diphenyl-4-bromobutanenitrile, 2-Methyl-5-nitro-6-chloro phenol, KS-000046XM, ZX-AT020759, 4-bromo-2,2-diphenyl butyronitrile, 4-Bromo-2,2-Diphenyl-Mutyronitrile, ANW-29031, IMED56428482, NSC-80688, SBB057200, STL290424, 4-bromo-2,2-di(phenyl)butanenitrile, 4-Bromo-2,2-diphenylbutanenitrile #, 3-bromo-1-cyano-1,1-diphenylpropane, AKOS000121369, Butyronitrile, 4-bromo-2,2-diphenyl-, CS-W012134, MCULE-9201144590, MP-2225, OR22940, RTR-015713, TRA0078868, 3-bromo-1-cyano-1,1-diphenyl-propane, ACM39186588, KS-0000002D, 2-(Bromoethyl)-2,2-diphenylacetonitrile, 4-Bromo-2,2-diphenylbutyronitrile, 95%, AC-30316, AJ-13439, AS-11426, BC224508, BR-47501, CC-18165, CJ-01396, SC-17523, ZB005957, AB0009905, AX8016293, DB-049387, TR-015713, AM20060615, Benzeneacetonitrile, 4-bromo-2,2-diphenyl-, FT-0617729, ST24028920, ST45053775, EN300-16638, C-18740, I14-6451, InChI=1/C16H14BrN/c17-12-11-16(13-18,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10H,11-12H2, C16H14BrN, C16-H14-Br-N, 2-chloro-6-methyl-3-nitrophenol, 2-Methyl-5-Nitro-6-Chlorophenol, CID96575, 4-bromo-2,2-diphenyl butanenitrile, AR-1G1175, 6-CHLORO-2-METHYL-5-NITROPHENOL, B1331, 4-Bromo-2,2-diphenylbutyronitrile, 99% - 100G 100g, 4104-74-9,

Complexity	274
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	299.031g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	300.199g/mol
Monoisotopic Mass	299.031g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number