AG003R2C

28322-40-9 | Isoamyltriphenylphosphonium bromide

AG003R2C

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CAS Number	28322-40-9
Catalog Number	AG003R2C(AGN-PC-0KKN6D)
Chemical Name	Isoamyltriphenylphosphonium bromide
EC Number	248-966-4
IUPAC Name	3-methylbutyl(triphenyl)phosphanium;bromide
InChI	InChI=1S/C23H26P.BrH/c1-20(2)18-19-24(21-12-6-3-7-13-21,22-14-8-4-9-15-22)23-16-10-5-11-17-23;/h3-17,20H,18-19H2,1-2H3;1H/q+1;/p-1
InChI Key	GZLGTVRDLCJQTO-UHFFFAOYSA-M
MDL Number	MFCD00031594
Molecular Formula	C23H26BrP
Molecular Weight	413.3303
SMILES	CC(C)CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
Synonyms	28322-40-9, Isopentyltriphenylphosphonium bromide, Isoamyltriphenylphosphonium bromide, isoamyl triphenylphosphonium bromide, MFCD00031594, (3-methylbutyl)triphenylphosphanium bromide, 3-methylbutyl(triphenyl)phosphanium bromide, EINECS 248-966-4, ACMC-1CJQ9, AC1MC09S, SCHEMBL164818, Isoamyltriphenylphosphoniumbromide, CTK3J3595, GZLGTVRDLCJQTO-UHFFFAOYSA-M, iso-amyl triphenylphosphonium bromide, isoamyl triphenyl phosphonium bromide, isopentyl triphenylphosphonium bromide, AKOS015916636, MCULE-8505589129, NE10885, VZ32419, (3-Methylbutyl)triphenylphosphonium bromide, 3-methylbutyl(triphenyl)phosphonium bromide, DB-047378, RT-001563, (3-methylbutyl)-triphenylphosphonium bromide, FT-0604981, (3-Methyl-butyl)-triphenyl-phosphonium bromide, Phosphonium, (3-methylbutyl)triphenyl-, bromide, A819414, J-017043, Phosphonium,(3-methylbutyl)triphenyl-,bromide(1:1), I14-50030, C23-H26-P.Br, ACN-043184, CID2759379, 3-Methylbutyl(triphenyl)phosphanium;bromide, (2-Isopropoxyethyl)triphenylphosphonium bromide, 101610-48-4,

Complexity	298
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	412.096g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	413.339g/mol
Monoisotopic Mass	412.096g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

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