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116513-91-8 | 1-Naphthalenesulfonamide, N-(10-aminodecyl)-5-bromo-
CAS No: 116513-91-8 Catalog No: AG000CNW MDL No:
Product Description
Catalog Number:
AG000CNW
Chemical Name:
1-Naphthalenesulfonamide, N-(10-aminodecyl)-5-bromo-
CAS Number:
116513-91-8
Molecular Formula:
C20H29BrN2O2S
Molecular Weight:
441.4255
IUPAC Name:
N-(10-aminodecyl)-5-bromonaphthalene-1-sulfonamide
InChI:
InChI=1S/C20H29BrN2O2S/c21-19-13-9-12-18-17(19)11-10-14-20(18)26(24,25)23-16-8-6-4-2-1-3-5-7-15-22/h9-14,23H,1-8,15-16,22H2
InChI Key:
URBRYZLYDVIIRM-UHFFFAOYSA-N
SMILES:
NCCCCCCCCCCNS(=O)(=O)c1cccc2c1cccc2Br
Properties
Complexity:
481
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
440.113g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
441.428g/mol
Monoisotopic Mass:
440.113g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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