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89754-03-0

89754-03-0 | 2,4,6,8,10-Undecapentaenenitrile, 11-(2-furanyloxy)-

CAS No: 89754-03-0 Catalog No: AG0040U2 MDL No:

Product Description

Catalog Number:
AG0040U2
Chemical Name:
2,4,6,8,10-Undecapentaenenitrile, 11-(2-furanyloxy)-
CAS Number:
89754-03-0
Molecular Formula:
C15H13NO2
Molecular Weight:
239.2692
IUPAC Name:
11-(furan-2-yloxy)undeca-2,4,6,8,10-pentaenenitrile
InChI:
InChI=1S/C15H13NO2/c16-12-8-6-4-2-1-3-5-7-9-13-17-15-11-10-14-18-15/h1-11,13-14H
InChI Key:
VRFAHLBQXRKGPR-UHFFFAOYSA-N
SMILES:
N#CC=CC=CC=CC=CC=COc1ccco1

Properties

Complexity:
408  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.095g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.274g/mol
Monoisotopic Mass:
239.095g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
5  
XLogP3:
3.7  

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