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18795-32-9 | Phosphoric acid, bis(2-oxiranylmethyl) phenyl ester
CAS No: 18795-32-9 Catalog No: AG002GLO MDL No:
Product Description
Catalog Number:
AG002GLO
Chemical Name:
Phosphoric acid, bis(2-oxiranylmethyl) phenyl ester
CAS Number:
18795-32-9
Molecular Formula:
C12H15O6P
Molecular Weight:
286.2177
IUPAC Name:
bis(oxiran-2-ylmethyl) phenyl phosphate
InChI:
InChI=1S/C12H15O6P/c13-19(16-8-11-6-14-11,17-9-12-7-15-12)18-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2
InChI Key:
HLVMEDJYWHPKKB-UHFFFAOYSA-N
SMILES:
O=P(Oc1ccccc1)(OCC1OC1)OCC1OC1
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.061g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.22g/mol
Monoisotopic Mass:
286.061g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
69.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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