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100345-53-7

100345-53-7 | Phosphoramidic acid, bis(1-methylethyl)-, mono(2-cyanoethyl) ester (9CI)

CAS No: 100345-53-7 Catalog No: AG0001OH MDL No:

Product Description

Catalog Number:
AG0001OH
Chemical Name:
Phosphoramidic acid, bis(1-methylethyl)-, mono(2-cyanoethyl) ester (9CI)
CAS Number:
100345-53-7
Molecular Formula:
C9H18N2O3P-
Molecular Weight:
233.2246
IUPAC Name:
2-cyanoethoxy-[di(propan-2-yl)amino]phosphinate
InChI:
InChI=1S/C9H19N2O3P/c1-8(2)11(9(3)4)15(12,13)14-7-5-6-10/h8-9H,5,7H2,1-4H3,(H,12,13)/p-1
InChI Key:
GVCUOBQBKJUBEV-UHFFFAOYSA-M
SMILES:
CC(N(P(=O)(OCCC#N)[O-])C(C)C)C

Properties

Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.106g/mol
Formal Charge:
-1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.228g/mol
Monoisotopic Mass:
233.106g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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