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1-Cyclopropyl-1-(2,4-difluorophenyl)ethanol

HCID 24749679
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(O)(c1ccc(F)cc1F)C1CC1
InChIKey
AIDRZOCKGNBJFF-UHFFFAOYSA-N
Molecular formula
C11H12F2O
Average molar mass
198.21 g/mol
Monoisotopic mass
198.08562133

Names & identifiers

Preferred name
1-Cyclopropyl-1-(2,4-difluorophenyl)ethanol
IUPAC
1-cyclopropyl-1-(2,4-difluorophenyl)ethanol

Names & synonyms

SCHEMBL1349069AIDRZOCKGNBJFF-UHFFFAOYSA-NAKOS0120957301-Cyclopropyl-1-(2,4-difluorophenyl)ethanol

Database identifiers

PubChem CID
24749679

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
217

Related reactions

3 records
New reaction record
HRID 192952 reaction equation
HRID 192952As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 561416 reaction equation
HRID 561416As productuspto-grants-2011_11
HRID 561579 reaction equation
HRID 561579As reactantuspto-grants-2011_11

Compound notes

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