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120210-19-7 | Carbamothioic acid, 2-benzothiazolyl- (9CI)
CAS No: 120210-19-7 Catalog No: AG008YRH MDL No:
Product Description
Catalog Number:
AG008YRH
Chemical Name:
Carbamothioic acid, 2-benzothiazolyl- (9CI)
CAS Number:
120210-19-7
IUPAC Name:
1,3-benzothiazol-2-ylcarbamothioic S-acid
InChI:
InChI=1S/C8H6N2OS2/c11-8(12)10-7-9-5-3-1-2-4-6(5)13-7/h1-4H,(H2,9,10,11,12)
InChI Key:
RMEPIUFMLUVPHU-UHFFFAOYSA-N
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.992g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.269g/mol
Monoisotopic Mass:
209.992g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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