Synonyms
(1-ethoxy-1-oxopropan-2-yl)-triphenylphosphanium,bromide; AC1MJ2OV; BC005146; ST24026058; ETHYL 1-(TRIPHENYLPHOSPHONIO)PROPIONATE BROMIDE; TRA0097269; (1-ETHOXYCARBONYLETHYL)TRIPHENYLPHOSPHONIUM BROMIDE 96%; ZX-AT008542; PHOSPHONIUM, (2-ETHOXY-1-METHYL-2-OXOETHYL)TRIPHENYL-, BROMIDE; BCP21873;
IUPAC Name
(1-ethoxy-1-oxopropan-2-yl)-triphenylphosphanium;bromide;
Molecular Weight
443.321g/mol
Molecular Formula
C23H24BrO2P;
Canonical SMILES
CCOC(=O)C(C)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-];
InChI
InChI=1S/C23H24O2P.BrH/c1-3-25-23(24)19(2)26(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-19H,3H2,1-2H3;1H/q+1;/p-1;
InChI Key
RSYXORMKBUFAMS-UHFFFAOYSA-M;
Storage
Refrigerator (+4°C)
Complexity
386
Covalently-Bonded Unit Count
2
EC Number
250-002-2
Exact Mass
442.07g/mol
H-Bond Acceptor
3
Heavy Atom Count
27
Monoisotopic Mass
442.07g/mol
Rotatable Bond Count
7
Topological Polar Surface Area
26.3A^2
Undefined Atom Stereocenter Count
1
