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84166-26-7 | 1,2-Propanediamine, N,N'-dimethyl-N,N'-dinonyl-, N,N'-dioxide
CAS No: 84166-26-7 Catalog No: AG004YKN MDL No:
Product Description
Catalog Number:
AG004YKN
Chemical Name:
1,2-Propanediamine, N,N'-dimethyl-N,N'-dinonyl-, N,N'-dioxide
CAS Number:
84166-26-7
Molecular Formula:
C23H50N2O2
Molecular Weight:
386.6553
IUPAC Name:
1-N,2-N-dimethyl-1-N,2-N-di(nonyl)propane-1,2-diamine oxide
InChI:
InChI=1S/C23H50N2O2/c1-6-8-10-12-14-16-18-20-24(4,26)22-23(3)25(5,27)21-19-17-15-13-11-9-7-2/h23H,6-22H2,1-5H3
InChI Key:
PBQDHXJFRKIWSW-UHFFFAOYSA-N
SMILES:
CCCCCCCCC[N+](CC([N+](CCCCCCCCC)(C)[O-])C)(C)[O-]
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.387g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
386.665g/mol
Monoisotopic Mass:
386.387g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
36.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
7.5
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