200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 872597-01-8
872597-01-8 | 3-Quinolinecarboxaldehyde, 2-acetyl-
CAS No: 872597-01-8 Catalog No: AG004PYY MDL No:
Product Description
Catalog Number:
AG004PYY
Chemical Name:
3-Quinolinecarboxaldehyde, 2-acetyl-
CAS Number:
872597-01-8
Molecular Formula:
C12H9NO2
Molecular Weight:
199.2054
IUPAC Name:
2-acetylquinoline-3-carbaldehyde
InChI:
InChI=1S/C12H9NO2/c1-8(15)12-10(7-14)6-9-4-2-3-5-11(9)13-12/h2-7H,1H3
InChI Key:
BEDQKXKCEFUQHB-UHFFFAOYSA-N
SMILES:
O=Cc1cc2ccccc2nc1C(=O)C
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.063g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.209g/mol
Monoisotopic Mass:
199.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.