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Home > Indoles and Oxindole > 33512-26-4
33512-26-4 | Diethyl ((1,3-dioxoisoindolin-2-yl)methyl)phosphonate
CAS No: 33512-26-4 Catalog No: AG003PEZ MDL No:MFCD00134313
Product Description
Catalog Number:
AG003PEZ
Chemical Name:
Diethyl ((1,3-dioxoisoindolin-2-yl)methyl)phosphonate
CAS Number:
33512-26-4
Molecular Formula:
C13H16NO5P
Molecular Weight:
297.2436
MDL Number:
MFCD00134313
IUPAC Name:
2-(diethoxyphosphorylmethyl)isoindole-1,3-dione
InChI:
InChI=1S/C13H16NO5P/c1-3-18-20(17,19-4-2)9-14-12(15)10-7-5-6-8-11(10)13(14)16/h5-8H,3-4,9H2,1-2H3
InChI Key:
IUZMHUAHKBHJFY-UHFFFAOYSA-N
SMILES:
CCOP(=O)(CN1C(=O)c2c(C1=O)cccc2)OCC
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.077g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.247g/mol
Monoisotopic Mass:
297.077g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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