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2486-89-7 | 1-Dodecanamine, N,N-didodecyl-, hydrochloride (1:1)
CAS No: 2486-89-7 Catalog No: AG002PO6 MDL No:
Product Description
Catalog Number:
AG002PO6
Chemical Name:
1-Dodecanamine, N,N-didodecyl-, hydrochloride (1:1)
CAS Number:
2486-89-7
Molecular Formula:
C36H76ClN
Molecular Weight:
558.4483
IUPAC Name:
N,N-didodecyldodecan-1-amine;hydrochloride
InChI:
InChI=1S/C36H75N.ClH/c1-4-7-10-13-16-19-22-25-28-31-34-37(35-32-29-26-23-20-17-14-11-8-5-2)36-33-30-27-24-21-18-15-12-9-6-3;/h4-36H2,1-3H3;1H
InChI Key:
GPQCSCQDQNXQSV-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCN(CCCCCCCCCCCC)CCCCCCCCCCCC.Cl
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
557.567g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
558.461g/mol
Monoisotopic Mass:
557.567g/mol
Rotatable Bond Count:
33
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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