5-(Fluoromethyl)-2-furaldehyde

HCID 11971254CAS 94043-06-8
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Basic information

Standard SMILES
O=Cc1ccc(CF)o1
InChIKey
NWOKZDMHAXVEJJ-UHFFFAOYSA-N
Molecular formula
C6H5FO2
Average molar mass
128.1 g/mol
Monoisotopic mass
128.02735762

Names & identifiers

Preferred name
5-(Fluoromethyl)-2-furaldehyde
IUPAC
5-(fluoromethyl)furan-2-carbaldehyde
English name
5-(fluoromethyl)-2-furaldehyde
Molecular formula
C6H5FO2
Molecular weight
128.1011032

Names & synonyms

94043-06-85-(Fluoromethyl)-2-furaldehyde5-(fluoromethyl)furan-2-carbaldehydeMZA4Z1UAY1EINECS 301-775-02-Furancarboxaldehyde, 5-(fluoromethyl)-5-(fluoromethyl)furfuralUNII-MZA4Z1UAY15-FLUOROMETHYLFURFURALSCHEMBL13226970DTXSID90240357NWOKZDMHAXVEJJ-UHFFFAOYSA-N
Show more names
5-(Fluoromethyl)-2-furancarbaldehyde
NS00065011

Database identifiers

CAS
94043-06-8
PubChem CID
11971254
DTXSID
DTXSID90240357
UNII
MZA4Z1UAY1
EC Number
301-775-0
Nikkaji
J367.979I

Properties

Computed structural properties

XLogP
0.4
Topological polar surface area
30.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
9

Physicochemical properties

FDA UNII
4 Z1UAY1 · MZA4Z1UAY1

Related reactions

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Linked notes

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