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141456-11-3 | Acetamide, 2-(phosphonooxy)-N-propyl-
CAS No: 141456-11-3 Catalog No: AG001GF8 MDL No:
Product Description
Catalog Number:
AG001GF8
Chemical Name:
Acetamide, 2-(phosphonooxy)-N-propyl-
CAS Number:
141456-11-3
Molecular Formula:
C5H12NO5P
Molecular Weight:
197.1262
IUPAC Name:
[2-oxo-2-(propylamino)ethyl] dihydrogen phosphate
InChI:
InChI=1S/C5H12NO5P/c1-2-3-6-5(7)4-11-12(8,9)10/h2-4H2,1H3,(H,6,7)(H2,8,9,10)
InChI Key:
DKBTUJDOHFLRRZ-UHFFFAOYSA-N
SMILES:
CCCNC(=O)COP(=O)(O)O
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.045g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
197.127g/mol
Monoisotopic Mass:
197.045g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
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