AG003AZ2

59159-39-6 | (2-(tert-Butoxy)-2-oxoethyl)triphenylphosphonium bromide

AG003AZ2

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CAS Number	59159-39-6
Catalog Number	AG003AZ2(AGN-PC-0KK68B)
Chemical Name	(2-(tert-Butoxy)-2-oxoethyl)triphenylphosphonium bromide
IUPAC Name	[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-triphenylphosphanium;bromide
InChI	InChI=1S/C24H26O2P.BrH/c1-24(2,3)26-23(25)19-27(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18H,19H2,1-3H3;1H/q+1;/p-1
InChI Key	ZGLFRTJDWWKIAK-UHFFFAOYSA-M
MDL Number	MFCD00075527
Molecular Formula	C24H26BrO2P
Molecular Weight	457.3398
NSC Number	82468
SMILES	O=C(OC(C)(C)C)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
Synonyms	59159-39-6, (2-(tert-Butoxy)-2-oxoethyl)triphenylphosphonium bromide, (tert-Butoxycarbonylmethyl)triphenylphosphonium bromide, (tert-Butoxycarbonylmethyl)triphenylphosphanium bromide, MFCD00075527, (tert-Butoxycarbonylmethyl)tripheenyphosphonium bromide, AK167441, Phosphonium, [2-(1,1-dimethylethoxy)-2-oxoethyl]triphenyl-, bromide, ZGLFRTJDWWKIAK-UHFFFAOYSA-M, ACMC-20apek, AC1MBZTC, KSC609K1L, SCHEMBL629737, CTK5A9515, KS-00000IAR, DTXSID00370018, NSC82468, NSC 82468, NSC-82468, AKOS008901294, TRA0058524, VZ20211, AN-39689, SC-85612, TC-172595, B3928, FT-0640586, carbo-t-butoxymethyl triphenylphosphonium bromide, (tert-butoxy carbonyl methyl) triphenyl phosphoniu, A832189, Carbo-tert-butoxymethyl triphenylphosphonium bromide, (2-tert-butoxy-2-oxoethyl)triphenylphosphonium bromide, I14-86018, (2-(tert-butoxy)-2-oxoethyl)triphenylphosphanium bromide, (2-tert-Butoxy-2-oxoethyl)(triphenyl)phosphanium bromide, (tert-butoxycarbonylmethyl)-triphenylphosphonium bromide, (2-tert-butoxy-2-oxo-ethyl)-triphenyl-phosphonium bromide, [2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-triphenylphosphanium bromide, [2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-triphenylphosphonium bromide, Phosphonium,[2-(1,1-dimethylethoxy)-2-oxoethyl]triphenyl-, bromide (1:1), [2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide, triphenylphosphaniumbromide, CID2733853, (2-methylpropan-2-yl)oxycarbonylmethyl-triphenyl-phosphanium Bromide, (tert-Butoxycarbonylmethyl)triphenylphosphonium bromide, 98% - 5G 5g,

Complexity	418
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	456.085g/mol
Formal Charge	0
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	457.348g/mol
Monoisotopic Mass	456.085g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	26.3A^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

Certificate of Analysis

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