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Home > Aldehydes > 1621615-09-5
1621615-09-5 | 3-Quinolinecarboxaldehyde, 2-chloro-7-(trifluoromethyl)-
CAS No: 1621615-09-5 Catalog No: AG001STD MDL No:MFCD28977409
Product Description
Catalog Number:
AG001STD
Chemical Name:
3-Quinolinecarboxaldehyde, 2-chloro-7-(trifluoromethyl)-
CAS Number:
1621615-09-5
Molecular Formula:
C11H5ClF3NO
Molecular Weight:
259.6117
MDL Number:
MFCD28977409
IUPAC Name:
2-chloro-7-(trifluoromethyl)quinoline-3-carbaldehyde
InChI:
InChI=1S/C11H5ClF3NO/c12-10-7(5-17)3-6-1-2-8(11(13,14)15)4-9(6)16-10/h1-5H
InChI Key:
MPQTZOWCOJIVHN-UHFFFAOYSA-N
SMILES:
O=Cc1cc2ccc(cc2nc1Cl)C(F)(F)F
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.001g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.612g/mol
Monoisotopic Mass:
259.001g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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