Home Other Building Blocks Biphenyl-4-carbothioic acid amide

Biphenyl-4-carbothioic acid amide

CAS No.:
13363-50-3
Catalog Number:
AG009AZ9
Molecular Formula:
C13H11NS
Molecular Weight:
213.2981
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$88
- +
1g
97%
1 week
United States
$188
- +
5g
97%
1 week
United States
$663
- +
Product Description
Catalog Number:
AG009AZ9
Chemical Name:
Biphenyl-4-carbothioic acid amide
CAS Number:
13363-50-3
Molecular Formula:
C13H11NS
Molecular Weight:
213.2981
MDL Number:
MFCD02179225
IUPAC Name:
4-phenylbenzenecarbothioamide
InChI:
InChI=1S/C13H11NS/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H2,14,15)
InChI Key:
HYDDAJTWPBWUOB-UHFFFAOYSA-N
SMILES:
NC(=S)c1ccc(cc1)c1ccccc1
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.061g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.298g/mol
Monoisotopic Mass:
213.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties