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928642-01-7

928642-01-7 | Quinoline, 5,5'-(1,3-butadiyne-1,4-diyl)bis-

CAS No: 928642-01-7 Catalog No: AG006KZ3 MDL No:

Product Description

Catalog Number:
AG006KZ3
Chemical Name:
Quinoline, 5,5'-(1,3-butadiyne-1,4-diyl)bis-
CAS Number:
928642-01-7
Molecular Formula:
C22H12N2
Molecular Weight:
304.3441
IUPAC Name:
5-(4-quinolin-5-ylbuta-1,3-diynyl)quinoline
InChI:
InChI=1S/C22H12N2/c1(7-17-9-3-13-21-19(17)11-5-15-23-21)2-8-18-10-4-14-22-20(18)12-6-16-24-22/h3-6,9-16H
InChI Key:
HLHVGBVJMPPIIC-UHFFFAOYSA-N
SMILES:
C(#Cc1cccc2c1cccn2)C#Cc1cccc2c1cccn2

Properties

Complexity:
516  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.1g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.352g/mol
Monoisotopic Mass:
304.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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