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5717-37-3 | (1-Ethoxycarbonylethylidene)Triphenylphosphorane
CAS No: 5717-37-3 Catalog No: AG0032B7 MDL No:MFCD00009160
Product Description
Catalog Number:
AG0032B7
Chemical Name:
(1-Ethoxycarbonylethylidene)Triphenylphosphorane
CAS Number:
5717-37-3
Molecular Formula:
C23H23O2P
Molecular Weight:
362.4013
MDL Number:
MFCD00009160
IUPAC Name:
ethyl 2-(triphenyl-λ5-phosphanylidene)propanoate
InChI:
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
InChI Key:
KZENFXVDPUMQOE-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)C
EC Number:
227-215-4
NSC Number:
76468
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.144g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
362.409g/mol
Monoisotopic Mass:
362.144g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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