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66021-69-0 | 2-Benzothiazolesulfenothioicacid(9CI)
CAS No: 66021-69-0 Catalog No: AG00FJY0 MDL No:
Product Description
Catalog Number:
AG00FJY0
Chemical Name:
2-Benzothiazolesulfenothioicacid(9CI)
CAS Number:
66021-69-0
IUPAC Name:
2-(disulfanyl)-1,3-benzothiazole
InChI:
InChI=1S/C7H5NS3/c9-11-7-8-5-3-1-2-4-6(5)10-7/h1-4,9H
InChI Key:
IZCHGOJNIHQWHP-UHFFFAOYSA-N
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.958g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.304g/mol
Monoisotopic Mass:
198.958g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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