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Home > Pyridines > 100961-94-2
100961-94-2 | Quinazoline, 2-[2-(3-pyridinyl)ethenyl]-
CAS No: 100961-94-2 Catalog No: AG0003CC MDL No:
Product Description
Catalog Number:
AG0003CC
Chemical Name:
Quinazoline, 2-[2-(3-pyridinyl)ethenyl]-
CAS Number:
100961-94-2
Molecular Formula:
C15H11N3
Molecular Weight:
233.2679
IUPAC Name:
2-(2-pyridin-3-ylethenyl)quinazoline
InChI:
InChI=1S/C15H11N3/c1-2-6-14-13(5-1)11-17-15(18-14)8-7-12-4-3-9-16-10-12/h1-11H
InChI Key:
WDEZYRYUPONAOL-UHFFFAOYSA-N
SMILES:
c1ccc(cn1)C=Cc1ncc2c(n1)cccc2
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.274g/mol
Monoisotopic Mass:
233.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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