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Home > Aldehydes > 118621-45-7
118621-45-7 | 6-Quinolinecarboxaldehyde, 1,2,3,4-tetrahydro-1-(4-methylphenyl)-
CAS No: 118621-45-7 Catalog No: AG008103 MDL No:
Product Description
Catalog Number:
AG008103
Chemical Name:
6-Quinolinecarboxaldehyde, 1,2,3,4-tetrahydro-1-(4-methylphenyl)-
CAS Number:
118621-45-7
Molecular Formula:
C17H17NO
Molecular Weight:
251.3230
IUPAC Name:
1-(4-methylphenyl)-3,4-dihydro-2H-quinoline-6-carbaldehyde
InChI:
InChI=1S/C17H17NO/c1-13-4-7-16(8-5-13)18-10-2-3-15-11-14(12-19)6-9-17(15)18/h4-9,11-12H,2-3,10H2,1H3
InChI Key:
RHSNKQJVLNLSKN-UHFFFAOYSA-N
SMILES:
O=Cc1ccc2c(c1)CCCN2c1ccc(cc1)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:
251.131g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.329g/mol
Monoisotopic Mass:
251.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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