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10205-63-7 | Benzenamine, N,N-diethyl-4-(6-methyl-2-benzothiazolyl)-
CAS No: 10205-63-7 Catalog No: AG0006GC MDL No:
Product Description
Catalog Number:
AG0006GC
Chemical Name:
Benzenamine, N,N-diethyl-4-(6-methyl-2-benzothiazolyl)-
CAS Number:
10205-63-7
Molecular Formula:
C18H20N2S
Molecular Weight:
296.4298
IUPAC Name:
N,N-diethyl-4-(6-methyl-1,3-benzothiazol-2-yl)aniline
InChI:
InChI=1S/C18H20N2S/c1-4-20(5-2)15-9-7-14(8-10-15)18-19-16-11-6-13(3)12-17(16)21-18/h6-12H,4-5H2,1-3H3
InChI Key:
YEMJQXMSJPHNFJ-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(cc1)c1nc2c(s1)cc(cc2)C)CC
EC Number:
233-507-2
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.135g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.432g/mol
Monoisotopic Mass:
296.135g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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