Synonyms
(Carbethoxyethylidene)triphenylphosphorane; (1-Ethoxycarbonylethylidene)triphenylphosphorane
IUPAC Name
ethyl 2-(triphenyl-lambda5-phosphanylidene)propanoate
Molecular Weight
362.41
Molecular Formula
C23H23O2P
Canonical SMILES
CCOC(=O)C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C;
InChI
KZENFXVDPUMQOE-UHFFFAOYSA-N
InChI Key
InChI=1S/C23H23O2P/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/h4-18H,3H2,1-2H3
Melting Point
193-195 °C(lit.)
Purity
98%
Appearance
Solid
Storage
0-6°C
Complexity
454
Covalently-Bonded Unit Count
1
EC Number
227-215-4
Exact Mass
362.144g/mol
H-Bond Acceptor
2
Heavy Atom Count
26
Isomeric SMILES
CCOC(=O)C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C
Monoisotopic Mass
362.144g/mol
NSC Number
76468
Rotatable Bond Count
6
Topological Polar Surface Area
26.3A^2
