AG002K1I

2091-46-5 | Propargyltriphenylphosphonium bromide

AG002K1I

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CAS Number	2091-46-5
Catalog Number	AG002K1I(AGN-PC-0KK06T)
Chemical Name	Propargyltriphenylphosphonium bromide
EC Number	218-242-2
IUPAC Name	triphenyl(prop-2-ynyl)phosphanium;bromide
InChI	InChI=1S/C21H18P.BrH/c1-2-18-22(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;/h1,3-17H,18H2;1H/q+1;/p-1
InChI Key	AFZDAWIXETXKRE-UHFFFAOYSA-M
MDL Number	MFCD00011811
Molecular Formula	C21H18BrP
Molecular Weight	381.2454
NSC Number	219251
SMILES	C#CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
Synonyms	2091-46-5, Triphenylpropargylphosphonium bromide, Propargyltriphenylphosphonium bromide, Triphenyl(prop-2-yn-1-yl)phosphonium bromide, Prop-2-ynyltriphenylphosphonium bromide, MFCD00011811, Propargyl triphenylphosphonium bromide, triphenyl(prop-2-ynyl)phosphonium bromide, ACMC-1CBAG, AC1MC4GI, SCHEMBL588651, CTK8B1172, AFZDAWIXETXKRE-UHFFFAOYSA-M, Propargyltriphenylphosphoniumbromide, TriphenylpropargylphosphoniumBromide, KS-000012BL, AN-030, ANW-24276, NSC219251, AKOS015833053, triphenylprop-2-ynylphosphine, bromide, LS41373, MCULE-4614348646, NSC-219251, Triphenyl-2-propynylphosphonium bromide, VA11601, Triphenyl(2-propynyl)phosphonium Bromide, ACM2091465|1, AK167467, ST097246, triphenyl(prop-2-ynyl)phosphanium bromide, triphenyl(prop-2-ynyl)phosphanium,bromide, Triphenylpropargylphosphonium bromide, 98%, DB-045432, TR-009829, CS-0063207, FT-0634030, P1438, J-013717, I14-58453, PHOSPHONIUM,TRIPHENYL-2-PROPYN-1-YL-, BROMIDE (1:1), Phosphonium, bromide, ACN-042185, CID2724214, Triphenyl-prop-2-ynyl-phosphanium Bromide,

Complexity	326
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	380.033g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	381.253g/mol
Monoisotopic Mass	380.033g/mol
Rotatable Bond Count	4
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	H302-H315-H319
Packing Group
Precautionary statements	P264-P270-P280-P301+P312+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P501
UN Code	\N

Certificate of Analysis

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