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Home > Aldehydes > 1260890-87-6
1260890-87-6 | 5-Isoquinolinecarboxaldehyde, 6-fluoro-
CAS No: 1260890-87-6 Catalog No: AG000RJY MDL No:
Product Description
Catalog Number:
AG000RJY
Chemical Name:
5-Isoquinolinecarboxaldehyde, 6-fluoro-
CAS Number:
1260890-87-6
Molecular Formula:
C10H6FNO
Molecular Weight:
175.1591
IUPAC Name:
6-fluoroisoquinoline-5-carbaldehyde
InChI:
InChI=1S/C10H6FNO/c11-10-2-1-7-5-12-4-3-8(7)9(10)6-13/h1-6H
InChI Key:
GDZKUAWHDNPVIP-UHFFFAOYSA-N
SMILES:
O=Cc1c(F)ccc2c1ccnc2
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.162g/mol
Monoisotopic Mass:
175.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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