200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 823227-48-1
823227-48-1 | Benzonitrile, 2-[[2-[(4-cyanophenyl)ethynyl]phenyl]ethynyl]-
CAS No: 823227-48-1 Catalog No: AG005E5X MDL No:
Product Description
Catalog Number:
AG005E5X
Chemical Name:
Benzonitrile, 2-[[2-[(4-cyanophenyl)ethynyl]phenyl]ethynyl]-
CAS Number:
823227-48-1
Molecular Formula:
C24H12N2
Molecular Weight:
328.3655
IUPAC Name:
2-[2-[2-[2-(4-cyanophenyl)ethynyl]phenyl]ethynyl]benzonitrile
InChI:
InChI=1S/C24H12N2/c25-17-20-11-9-19(10-12-20)13-14-21-5-1-2-6-22(21)15-16-23-7-3-4-8-24(23)18-26/h1-12H
InChI Key:
FBWSXQAJTSDIEW-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)C#Cc1ccccc1C#Cc1ccccc1C#N
Properties
Complexity:
710
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.1g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.374g/mol
Monoisotopic Mass:
328.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.