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1677-85-6 | 1-Nonadecanaminium, N,N-dimethyl-N-nonadecyl-, chloride (1:1)
CAS No: 1677-85-6 Catalog No: AG001XKJ MDL No:
Product Description
Catalog Number:
AG001XKJ
Chemical Name:
1-Nonadecanaminium, N,N-dimethyl-N-nonadecyl-, chloride (1:1)
CAS Number:
1677-85-6
Molecular Formula:
C40H84ClN
Molecular Weight:
614.5547
IUPAC Name:
dimethyl-di(nonadecyl)azanium;chloride
InChI:
InChI=1S/C40H84N.ClH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41(3,4)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h5-40H2,1-4H3;1H/q+1;/p-1
InChI Key:
OXBYKMFDJQCKIJ-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCCC)(C)C.[Cl-]
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
613.629g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
614.569g/mol
Monoisotopic Mass:
613.629g/mol
Rotatable Bond Count:
36
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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