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57392-05-9 | Hydrazinecarbothioic acid, S-2-benzothiazolyl ester (9CI)
CAS No: 57392-05-9 Catalog No: AG00EYEA MDL No:
Product Description
Catalog Number:
AG00EYEA
Chemical Name:
Hydrazinecarbothioic acid, S-2-benzothiazolyl ester (9CI)
CAS Number:
57392-05-9
IUPAC Name:
S-(1,3-benzothiazol-2-yl) N-aminocarbamothioate
InChI:
InChI=1S/C8H7N3OS2/c9-11-7(12)14-8-10-5-3-1-2-4-6(5)13-8/h1-4H,9H2,(H,11,12)
InChI Key:
PQKJLDAWBPIRCA-UHFFFAOYSA-N
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.003g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
225.284g/mol
Monoisotopic Mass:
225.003g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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