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29904-98-1 | benzothiazole-2(3H)-thione, cobalt (2+) salt
CAS No: 29904-98-1 Catalog No: AG00BLV6 MDL No:
Product Description
Catalog Number:
AG00BLV6
Chemical Name:
benzothiazole-2(3H)-thione, cobalt (2+) salt
CAS Number:
29904-98-1
IUPAC Name:
1,3-benzothiazole-2-thiolate;cobalt(2+)
InChI:
InChI=1S/2C7H5NS2.Co/c2*9-7-8-5-3-1-2-4-6(5)10-7;/h2*1-4H,(H,8,9);/q;;+2/p-2
InChI Key:
RYMUATUZIJMPBZ-UHFFFAOYSA-L
EC Number:
249-945-2
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
390.89g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
391.405g/mol
Monoisotopic Mass:
390.89g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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