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38912-41-3

38912-41-3 | Ethanethioamide, N-2-benzothiazolyl- (9CI)

CAS No: 38912-41-3 Catalog No: AG00CI8U MDL No:

Product Description

Catalog Number:
AG00CI8U
Chemical Name:
Ethanethioamide, N-2-benzothiazolyl- (9CI)
CAS Number:
38912-41-3
IUPAC Name:
N-(1,3-benzothiazol-2-yl)ethanethioamide
InChI:
InChI=1S/C9H8N2S2/c1-6(12)10-9-11-7-4-2-3-5-8(7)13-9/h2-5H,1H3,(H,10,11,12)
InChI Key:
WJVLYBZGQRVKKU-UHFFFAOYSA-N

Properties

Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.013g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.297g/mol
Monoisotopic Mass:
208.013g/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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