200,000+ products from a single source!
sales@angenechem.com
13238-38-5 | Pyridine, 3-(2-phenylethynyl)-
CAS No: 13238-38-5 Catalog No: AG0010MB MDL No:MFCD09029837
Product Description
Catalog Number:
AG0010MB
Chemical Name:
Pyridine, 3-(2-phenylethynyl)-
CAS Number:
13238-38-5
Molecular Formula:
C13H9N
Molecular Weight:
179.2173
MDL Number:
MFCD09029837
IUPAC Name:
3-(2-phenylethynyl)pyridine
InChI:
InChI=1S/C13H9N/c1-2-5-12(6-3-1)8-9-13-7-4-10-14-11-13/h1-7,10-11H
InChI Key:
ZLYFXWKSLUXFMU-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C#Cc1cccnc1
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.073g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.222g/mol
Monoisotopic Mass:
179.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| (Z)-1-Acetyl-3-[2-oxo-1-phenyl-2-(3-pyrid-yl)ethyl-idene]indolin-2-one. | Acta crystallographica. Section E, Structure reports online 20100901 |
Related Products
© 2019 Angene International Limited. All rights Reserved.