Home Halogens Benzeneethanethioamide, 2-chloro-4-fluoro-

Benzeneethanethioamide, 2-chloro-4-fluoro-

CAS No.:
306937-36-0
Catalog Number:
AG0030Z0
Molecular Formula:
C8H7ClFNS
Molecular Weight:
203.6643
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Product Description
Catalog Number:
AG0030Z0
Chemical Name:
Benzeneethanethioamide, 2-chloro-4-fluoro-
CAS Number:
306937-36-0
Molecular Formula:
C8H7ClFNS
Molecular Weight:
203.6643
MDL Number:
MFCD02677694
IUPAC Name:
2-(2-chloro-4-fluorophenyl)ethanethioamide
InChI:
InChI=1S/C8H7ClFNS/c9-7-4-6(10)2-1-5(7)3-8(11)12/h1-2,4H,3H2,(H2,11,12)
InChI Key:
WPGSTNBGSBXLKT-UHFFFAOYSA-N
SMILES:
NC(=S)Cc1ccc(cc1Cl)F
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.997g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.659g/mol
Monoisotopic Mass:
202.997g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties