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40115-02-4 | Benzothiazole, 2-cyclopentyl- (9CI)
CAS No: 40115-02-4 Catalog No: AG00CIBO MDL No:
Product Description
Catalog Number:
AG00CIBO
Chemical Name:
Benzothiazole, 2-cyclopentyl- (9CI)
CAS Number:
40115-02-4
IUPAC Name:
2-cyclopentyl-1,3-benzothiazole
InChI:
InChI=1S/C12H13NS/c1-2-6-9(5-1)12-13-10-7-3-4-8-11(10)14-12/h3-4,7-9H,1-2,5-6H2
InChI Key:
AJVKUDDCRQQPBY-UHFFFAOYSA-N
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.077g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.303g/mol
Monoisotopic Mass:
203.077g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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