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Home > Aldehydes > 1466250-56-5
1466250-56-5 | 1H-Pyrrole-2-carboxaldehyde, 4-fluoro-
CAS No: 1466250-56-5 Catalog No: AG001E6P MDL No:
Product Description
Catalog Number:
AG001E6P
Chemical Name:
1H-Pyrrole-2-carboxaldehyde, 4-fluoro-
CAS Number:
1466250-56-5
Molecular Formula:
C5H4FNO
Molecular Weight:
113.0898
IUPAC Name:
4-fluoro-1H-pyrrole-2-carbaldehyde
InChI:
InChI=1S/C5H4FNO/c6-4-1-5(3-8)7-2-4/h1-3,7H
InChI Key:
TWEVFIDOBCXAMU-UHFFFAOYSA-N
SMILES:
Fc1cc([nH]c1)C=O
Properties
Complexity:
96.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.028g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
113.091g/mol
Monoisotopic Mass:
113.028g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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