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140173-70-2 | Phosphonic acid, [[hydroxy(phenylmethyl)amino]methyl]-, dimethyl ester (9CI)
CAS No: 140173-70-2 Catalog No: AG001C47 MDL No:
Product Description
Catalog Number:
AG001C47
Chemical Name:
Phosphonic acid, [[hydroxy(phenylmethyl)amino]methyl]-, dimethyl ester (9CI)
CAS Number:
140173-70-2
Molecular Formula:
C10H16NO4P
Molecular Weight:
245.2121
IUPAC Name:
N-benzyl-N-(dimethoxyphosphorylmethyl)hydroxylamine
InChI:
InChI=1S/C10H16NO4P/c1-14-16(13,15-2)9-11(12)8-10-6-4-3-5-7-10/h3-7,12H,8-9H2,1-2H3
InChI Key:
LRHAWKIFKLOFPA-UHFFFAOYSA-N
SMILES:
COP(=O)(CN(Cc1ccccc1)O)OC
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.082g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.215g/mol
Monoisotopic Mass:
245.082g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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