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72255-20-0 | 1-Decanaminium, N,N-diethyl-N-(2-hydroxyethyl)-
CAS No: 72255-20-0 Catalog No: AG005J33 MDL No:
Product Description
Catalog Number:
AG005J33
Chemical Name:
1-Decanaminium, N,N-diethyl-N-(2-hydroxyethyl)-
CAS Number:
72255-20-0
Molecular Formula:
C16H36NO+
Molecular Weight:
258.4631
IUPAC Name:
decyl-diethyl-(2-hydroxyethyl)azanium
InChI:
InChI=1S/C16H36NO/c1-4-7-8-9-10-11-12-13-14-17(5-2,6-3)15-16-18/h18H,4-16H2,1-3H3/q+1
InChI Key:
GKYWDHMBFFLILN-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC[N+](CCO)(CC)CC
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.28g/mol
Formal Charge:
1
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.47g/mol
Monoisotopic Mass:
258.28g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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