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78158-96-0

78158-96-0 | Methanethioamide, N-2-benzothiazolyl- (9CI)

CAS No: 78158-96-0 Catalog No: AG00GH0G MDL No:

Product Description

Catalog Number:
AG00GH0G
Chemical Name:
Methanethioamide, N-2-benzothiazolyl- (9CI)
CAS Number:
78158-96-0
IUPAC Name:
N-(1,3-benzothiazol-2-yl)methanethioamide
InChI:
InChI=1S/C8H6N2S2/c11-5-9-8-10-6-3-1-2-4-7(6)12-8/h1-5H,(H,9,10,11)
InChI Key:
UVRKAMHZOFYBPB-UHFFFAOYSA-N

Properties

Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.997g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.27g/mol
Monoisotopic Mass:
193.997g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
85.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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