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1018-24-2 | Phosphonic acid, P-(2-phenylethenyl)-, diethyl ester
CAS No: 1018-24-2 Catalog No: AG0005LR MDL No:
Product Description
Catalog Number:
AG0005LR
Chemical Name:
Phosphonic acid, P-(2-phenylethenyl)-, diethyl ester
CAS Number:
1018-24-2
Molecular Formula:
C12H17O3P
Molecular Weight:
240.2353
IUPAC Name:
[(E)-2-diethoxyphosphorylethenyl]benzene
InChI:
InChI=1S/C12H17O3P/c1-3-14-16(13,15-4-2)11-10-12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3/b11-10+
InChI Key:
YFPQECGBFLMFEI-ZHACJKMWSA-N
SMILES:
CCOP(=O)(C=Cc1ccccc1)OCC
NSC Number:
72385
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
240.092g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.239g/mol
Monoisotopic Mass:
240.092g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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