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Home > Aldehydes > 126921-16-2
126921-16-2 | 1H-Indole-3-carboxaldehyde, 7-fluoro-
CAS No: 126921-16-2 Catalog No: AG000TGU MDL No:MFCD03095352
Product Description
Catalog Number:
AG000TGU
Chemical Name:
1H-Indole-3-carboxaldehyde, 7-fluoro-
CAS Number:
126921-16-2
Molecular Formula:
C9H6FNO
Molecular Weight:
163.1484
MDL Number:
MFCD03095352
IUPAC Name:
7-fluoro-1H-indole-3-carbaldehyde
InChI:
InChI=1S/C9H6FNO/c10-8-3-1-2-7-6(5-12)4-11-9(7)8/h1-5,11H
InChI Key:
AHVRLLVALCYEEP-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1cccc2F
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.151g/mol
Monoisotopic Mass:
163.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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