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128176-61-4 | Phosphonic acid, 2-propenyl-, bis(4-methoxyphenyl) ester (9CI)
CAS No: 128176-61-4 Catalog No: AG000XUE MDL No:
Product Description
Catalog Number:
AG000XUE
Chemical Name:
Phosphonic acid, 2-propenyl-, bis(4-methoxyphenyl) ester (9CI)
CAS Number:
128176-61-4
Molecular Formula:
C17H19O5P
Molecular Weight:
334.3035
IUPAC Name:
1-methoxy-4-[(4-methoxyphenoxy)-prop-2-enylphosphoryl]oxybenzene
InChI:
InChI=1S/C17H19O5P/c1-4-13-23(18,21-16-9-5-14(19-2)6-10-16)22-17-11-7-15(20-3)8-12-17/h4-12H,1,13H2,2-3H3
InChI Key:
RQFCESOFNWBUTP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)OP(=O)(Oc1ccc(cc1)OC)CC=C
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.097g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.308g/mol
Monoisotopic Mass:
334.097g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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