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190962-81-3 | Phosphonic acid, P-(1-methylpropyl)-, diphenyl ester
CAS No: 190962-81-3 Catalog No: AG002EXU MDL No:
Product Description
Catalog Number:
AG002EXU
Chemical Name:
Phosphonic acid, P-(1-methylpropyl)-, diphenyl ester
CAS Number:
190962-81-3
Molecular Formula:
C16H19O3P
Molecular Weight:
290.2940
IUPAC Name:
[butan-2-yl(phenoxy)phosphoryl]oxybenzene
InChI:
InChI=1S/C16H19O3P/c1-3-14(2)20(17,18-15-10-6-4-7-11-15)19-16-12-8-5-9-13-16/h4-14H,3H2,1-2H3
InChI Key:
YSKXQPGIFJJARF-UHFFFAOYSA-N
SMILES:
CCC(P(=O)(Oc1ccccc1)Oc1ccccc1)C
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.107g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.299g/mol
Monoisotopic Mass:
290.107g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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