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149228-27-3 | 1-Dodecanaminium, N-(2-hydroxypropyl)-N,N-dimethyl-
CAS No: 149228-27-3 Catalog No: AG001LH8 MDL No:
Product Description
Catalog Number:
AG001LH8
Chemical Name:
1-Dodecanaminium, N-(2-hydroxypropyl)-N,N-dimethyl-
CAS Number:
149228-27-3
Molecular Formula:
C17H38NO+
Molecular Weight:
272.4897
IUPAC Name:
dodecyl-(2-hydroxypropyl)-dimethylazanium
InChI:
InChI=1S/C17H38NO/c1-5-6-7-8-9-10-11-12-13-14-15-18(3,4)16-17(2)19/h17,19H,5-16H2,1-4H3/q+1
InChI Key:
SDAMFUVRUIHGCU-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC[N+](CC(O)C)(C)C
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.295g/mol
Formal Charge:
1
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.497g/mol
Monoisotopic Mass:
272.295g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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