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114527-61-6 | Phosphoric acid, mono(4-hydroxyphenyl) monophenyl ester
CAS No: 114527-61-6 Catalog No: AG000EMN MDL No:
Product Description
Catalog Number:
AG000EMN
Chemical Name:
Phosphoric acid, mono(4-hydroxyphenyl) monophenyl ester
CAS Number:
114527-61-6
Molecular Formula:
C12H10O5P-
Molecular Weight:
265.1786
IUPAC Name:
(4-hydroxyphenyl) phenyl phosphate
InChI:
InChI=1S/C12H11O5P/c13-10-6-8-12(9-7-10)17-18(14,15)16-11-4-2-1-3-5-11/h1-9,13H,(H,14,15)/p-1
InChI Key:
TUBVQVOADJADLU-UHFFFAOYSA-M
SMILES:
Oc1ccc(cc1)OP(=O)(Oc1ccccc1)[O-]
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.027g/mol
Formal Charge:
-1
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.181g/mol
Monoisotopic Mass:
265.027g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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