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78804-00-9 | 1,3,2-Dioxaphosphole, 4-ethoxy-2-methoxy-5-phenyl-, 2-oxide
CAS No: 78804-00-9 Catalog No: AG005DHG MDL No:
Product Description
Catalog Number:
AG005DHG
Chemical Name:
1,3,2-Dioxaphosphole, 4-ethoxy-2-methoxy-5-phenyl-, 2-oxide
CAS Number:
78804-00-9
Molecular Formula:
C11H13O5P
Molecular Weight:
256.1917
IUPAC Name:
4-ethoxy-2-methoxy-5-phenyl-1,3,2λ5-dioxaphosphole 2-oxide
InChI:
InChI=1S/C11H13O5P/c1-3-14-11-10(9-7-5-4-6-8-9)15-17(12,13-2)16-11/h4-8H,3H2,1-2H3
InChI Key:
UNPVUJFWSSOTKV-UHFFFAOYSA-N
SMILES:
CCOC1=C(OP(=O)(O1)OC)c1ccccc1
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.05g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.194g/mol
Monoisotopic Mass:
256.05g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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