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13362-63-5 | Quinoline, 4-[(1E)-2-phenylethenyl]-
CAS No: 13362-63-5 Catalog No: AG007N83 MDL No:
Product Description
Catalog Number:
AG007N83
Chemical Name:
Quinoline, 4-[(1E)-2-phenylethenyl]-
CAS Number:
13362-63-5
Molecular Formula:
C17H13N
Molecular Weight:
231.2918
IUPAC Name:
4-(2-phenylethenyl)quinoline
InChI:
InChI=1S/C17H13N/c1-2-6-14(7-3-1)10-11-15-12-13-18-17-9-5-4-8-16(15)17/h1-13H
InChI Key:
LAAWYSBJZGYHRT-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)/C=C/c1ccnc2c1cccc2
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:
4.5
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