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Home > Pyridines > 652142-08-0
652142-08-0 | Pyridine, 4-[(1E)-2-(1-azulenyl)ethenyl]-
CAS No: 652142-08-0 Catalog No: AG00H6S9 MDL No:
Product Description
Catalog Number:
AG00H6S9
Chemical Name:
Pyridine, 4-[(1E)-2-(1-azulenyl)ethenyl]-
CAS Number:
652142-08-0
Molecular Formula:
C17H13N
Molecular Weight:
231.2918
IUPAC Name:
4-(2-azulen-1-ylethenyl)pyridine
InChI:
InChI=1S/C17H13N/c1-2-4-15-8-9-16(17(15)5-3-1)7-6-14-10-12-18-13-11-14/h1-13H
InChI Key:
KEAYFIVLHJFCHP-UHFFFAOYSA-N
SMILES:
n1ccc(cc1)/C=C/c1ccc2c1ccccc2
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.105g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.298g/mol
Monoisotopic Mass:
231.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.1
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