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125376-12-7 | Phosphoramidic acid, [(benzoylamino)methyl]-, dimethyl ester (9CI)
CAS No: 125376-12-7 Catalog No: AG000NK8 MDL No:
Product Description
Catalog Number:
AG000NK8
Chemical Name:
Phosphoramidic acid, [(benzoylamino)methyl]-, dimethyl ester (9CI)
CAS Number:
125376-12-7
Molecular Formula:
C10H15N2O4P
Molecular Weight:
258.2109
IUPAC Name:
N-[(dimethoxyphosphorylamino)methyl]benzamide
InChI:
InChI=1S/C10H15N2O4P/c1-15-17(14,16-2)12-8-11-10(13)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,11,13)(H,12,14)
InChI Key:
DEFLBCGZEAJZOQ-UHFFFAOYSA-N
SMILES:
COP(=O)(NCNC(=O)c1ccccc1)OC
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.077g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.214g/mol
Monoisotopic Mass:
258.077g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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