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66730-34-5 | Benzothiazole, 2-(1-cyclohexen-1-yl)- (9CI)
CAS No: 66730-34-5 Catalog No: AG00FJOF MDL No:
Product Description
Catalog Number:
AG00FJOF
Chemical Name:
Benzothiazole, 2-(1-cyclohexen-1-yl)- (9CI)
CAS Number:
66730-34-5
IUPAC Name:
2-(cyclohexen-1-yl)-1,3-benzothiazole
InChI:
InChI=1S/C13H13NS/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h4-6,8-9H,1-3,7H2
InChI Key:
GXIXMHPRMDHISM-UHFFFAOYSA-N
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.077g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.314g/mol
Monoisotopic Mass:
215.077g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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