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Home > Aldehydes > 893735-99-4
893735-99-4 | Benzaldehyde,4-(3-quinolinyl)-
CAS No: 893735-99-4 Catalog No: AG003XB0 MDL No:
Product Description
Catalog Number:
AG003XB0
Chemical Name:
Benzaldehyde,4-(3-quinolinyl)-
CAS Number:
893735-99-4
Molecular Formula:
C17H13NO
Molecular Weight:
247.2912
IUPAC Name:
4-(2-methylquinolin-6-yl)benzaldehyde
InChI:
InChI=1S/C17H13NO/c1-12-2-5-16-10-15(8-9-17(16)18-12)14-6-3-13(11-19)4-7-14/h2-11H,1H3
InChI Key:
OADHTSJQNYUVHX-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1ccc2c(c1)ccc(n2)C
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.297g/mol
Monoisotopic Mass:
247.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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