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58177-03-0 | Benzothiazole, 2,2-dibutyl-2,3-dihydro-3-methyl- (9CI)
CAS No: 58177-03-0 Catalog No: AG00EI2U MDL No:
Product Description
Catalog Number:
AG00EI2U
Chemical Name:
Benzothiazole, 2,2-dibutyl-2,3-dihydro-3-methyl- (9CI)
CAS Number:
58177-03-0
IUPAC Name:
2,2-dibutyl-3-methyl-1,3-benzothiazole
InChI:
InChI=1S/C16H25NS/c1-4-6-12-16(13-7-5-2)17(3)14-10-8-9-11-15(14)18-16/h8-11H,4-7,12-13H2,1-3H3
InChI Key:
SMAGKTSNRKRZTA-UHFFFAOYSA-N
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.171g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.443g/mol
Monoisotopic Mass:
263.171g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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