Home Halogens Benzeneethanethioamide, 2,6-dichloro-

Benzeneethanethioamide, 2,6-dichloro-

CAS No.:
17518-49-9
Catalog Number:
AG0020DS
Molecular Formula:
C8H7Cl2NS
Molecular Weight:
220.1189
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Product Description
Catalog Number:
AG0020DS
Chemical Name:
Benzeneethanethioamide, 2,6-dichloro-
CAS Number:
17518-49-9
Molecular Formula:
C8H7Cl2NS
Molecular Weight:
220.1189
MDL Number:
MFCD00052483
IUPAC Name:
2-(2,6-dichlorophenyl)ethanethioamide
InChI:
InChI=1S/C8H7Cl2NS/c9-6-2-1-3-7(10)5(6)4-8(11)12/h1-3H,4H2,(H2,11,12)
InChI Key:
FBAMANMRMUDYNM-UHFFFAOYSA-N
SMILES:
NC(=S)Cc1c(Cl)cccc1Cl
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.968g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.111g/mol
Monoisotopic Mass:
218.968g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties