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158848-73-8 | Phosphoric acid, 3-hydroxyphenyl bis(methylphenyl) ester (9CI)
CAS No: 158848-73-8 Catalog No: AG001QYI MDL No:
Product Description
Catalog Number:
AG001QYI
Chemical Name:
Phosphoric acid, 3-hydroxyphenyl bis(methylphenyl) ester (9CI)
CAS Number:
158848-73-8
Molecular Formula:
C20H19O5P
Molecular Weight:
370.3356
IUPAC Name:
(3-hydroxyphenyl) bis(2-methylphenyl) phosphate
InChI:
InChI=1S/C20H19O5P/c1-15-8-3-5-12-19(15)24-26(22,23-18-11-7-10-17(21)14-18)25-20-13-6-4-9-16(20)2/h3-14,21H,1-2H3
InChI Key:
SZMJGBCICWQEFE-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)OP(=O)(Oc1ccccc1C)Oc1ccccc1C
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.097g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
370.341g/mol
Monoisotopic Mass:
370.097g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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