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Home > Aldehydes > 1286734-88-0
1286734-88-0 | 1H-Indazole-6-carboxaldehyde, 5-fluoro-1-methyl-
CAS No: 1286734-88-0 Catalog No: AG000YA6 MDL No:
Product Description
Catalog Number:
AG000YA6
Chemical Name:
1H-Indazole-6-carboxaldehyde, 5-fluoro-1-methyl-
CAS Number:
1286734-88-0
Molecular Formula:
C9H7FN2O
Molecular Weight:
178.1631
IUPAC Name:
5-fluoro-1-methylindazole-6-carbaldehyde
InChI:
InChI=1S/C9H7FN2O/c1-12-9-3-7(5-13)8(10)2-6(9)4-11-12/h2-5H,1H3
InChI Key:
QVJLIFWOJJVJSA-UHFFFAOYSA-N
SMILES:
Cn1ncc2c1cc(C=O)c(c2)F
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.054g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.166g/mol
Monoisotopic Mass:
178.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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