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84863-83-2 | 2,3-Dichlorobenzothioamide
CAS No: 84863-83-2 Catalog No: AG003FHV MDL No:MFCD00221163
Product Description
Catalog Number:
AG003FHV
Chemical Name:
2,3-Dichlorobenzothioamide
CAS Number:
84863-83-2
Molecular Formula:
C7H5Cl2NS
Molecular Weight:
206.0923
MDL Number:
MFCD00221163
IUPAC Name:
2,3-dichlorobenzenecarbothioamide
InChI:
InChI=1S/C7H5Cl2NS/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H2,10,11)
InChI Key:
PRRMJTDPKZBCCQ-UHFFFAOYSA-N
SMILES:
NC(=S)c1cccc(c1Cl)Cl
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.952g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.084g/mol
Monoisotopic Mass:
204.952g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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