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15497-45-7 | 1H-Benzotriazole-1-methanamine, N,N-dibutyl-
CAS No: 15497-45-7 Catalog No: AG001NIA MDL No:
Product Description
Catalog Number:
AG001NIA
Chemical Name:
1H-Benzotriazole-1-methanamine, N,N-dibutyl-
CAS Number:
15497-45-7
Molecular Formula:
C15H24N4
Molecular Weight:
260.3779
IUPAC Name:
N-(benzotriazol-1-ylmethyl)-N-butylbutan-1-amine
InChI:
InChI=1S/C15H24N4/c1-3-5-11-18(12-6-4-2)13-19-15-10-8-7-9-14(15)16-17-19/h7-10H,3-6,11-13H2,1-2H3
InChI Key:
CODGFEFCDWSFSV-UHFFFAOYSA-N
SMILES:
CCCCN(Cn1nnc2c1cccc2)CCCC
EC Number:
239-524-1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.2g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.385g/mol
Monoisotopic Mass:
260.2g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
34A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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