{5-[3-(Trifluoromethyl)phenyl]furan-2-yl}methanol

HCID 7782745

Notes Reactions

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Basic information

CAS: 65385-42-4
Standard SMILES: OCc1ccc(-c2cccc(C(F)(F)F)c2)o1
InChIKey: XPXRIFIZAIPZDF-UHFFFAOYSA-N
Molecular formula: C12H9F3O2
Average molar mass: 242.19 g/mol
Monoisotopic mass: 242.05546419

Names & identifiers

Preferred name: {5-[3-(Trifluoromethyl)phenyl]furan-2-yl}methanol
IUPAC: [5-[3-(trifluoromethyl)phenyl]furan-2-yl]methanol

Names & synonyms

65385-42-42-Furanmethanol, 5-[3-(trifluoromethyl)phenyl]-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}methanolSCHEMBL1198267DTXSID60428928AKOS0001077912-hydroxymethyl-5-(3-trifluoromethylphenyl)-furan

Database identifiers

CAS: 65385-42-4
PubChem CID: 7782745
DTXSID: DTXSID60428928

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 33.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 2
Heavy atoms: 17
Formal charge: 0
Complexity: 255

Related reactions

5 records

New reaction record

HRID 806893As reactantTest data from https://doi.org/10.1039/C8SC04228D

HRID 830429As reactantTest data from https://doi.org/10.1039/C8SC04228D

HRID 1112740As productuspto-grants-1978_10

HRID 1112741As reactantuspto-grants-1978_10

HRID 1257477As reactantuspto-grants-2013_06

Compound notes

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