200,000+ products from a single source!

sales@angenechem.com

Home > Other Building Blocks > 916081-49-7

916081-49-7

916081-49-7 | Benzenecarbothioamide, 4-(2-phenylethynyl)-

CAS No: 916081-49-7 Catalog No: AG006FSF MDL No:

Product Description

Catalog Number:
AG006FSF
Chemical Name:
Benzenecarbothioamide, 4-(2-phenylethynyl)-
CAS Number:
916081-49-7
Molecular Formula:
C15H11NS
Molecular Weight:
237.3195
IUPAC Name:
4-(2-phenylethynyl)benzenecarbothioamide
InChI:
InChI=1S/C15H11NS/c16-15(17)14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h1-5,8-11H,(H2,16,17)
InChI Key:
SCZAHTLEYFPONL-UHFFFAOYSA-N
SMILES:
NC(=S)c1ccc(cc1)C#Cc1ccccc1

Properties

Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.061g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.32g/mol
Monoisotopic Mass:
237.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

Related Products

© 2019 Angene International Limited. All rights Reserved.