2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol

C12H15FO2 — CID 57425831

IUPAC2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol
SMILESOC1CC(COCc2ccccc2)C1F
InChIInChI=1S/C12H15FO2/c13-12-10(6-11(12)14)8-15-7-9-4-2-1-3-5-9/h1-5,10-12,14H,6-8H2
InChIKeyFKJVYPFLGWEKIW-UHFFFAOYSA-N
MW210.25 g/mol
LogP1.92
Rot. Bonds4

About 2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol

2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol (PubChem CID 57425831) has the molecular formula C12H15FO2 and a molecular weight of 210.25 g/mol. Its IUPAC name is 2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol.

Molecular Properties

Compound Name2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol
PubChem CID57425831
Molecular FormulaC12H15FO2
Molecular Weight210.25 g/mol
Exact Mass210.11
IUPAC Name2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol
SMILESOC1CC(COCc2ccccc2)C1F
InChIInChI=1S/C12H15FO2/c13-12-10(6-11(12)14)8-15-7-9-4-2-1-3-5-9/h1-5,10-12,14H,6-8H2
InChIKeyFKJVYPFLGWEKIW-UHFFFAOYSA-N
XLogP1.92
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-amine
CID 57425834
4-(phenylmethoxymethyl)cyclopentane-1,2-diol
CID 12717277
trans-(1R,2S)-2-(phenylmethoxymethyl)cyclopropane-1-carboxylic acid
CID 86340040
potassium trifluoro-[(1R,2R)-2-(phenylmethoxymethyl)cyclopropyl]boranuide
CID 135036909
trans-(1R,2R)-4-(phenylmethoxymethyl)cyclopentane-1,2-diamine
CID 57481680
[(1R,2R)-2-tert-butylcyclopropyl]methoxymethylbenzene
CID 10878630
[(1S,2S)-2-ethenylcyclopropyl]methoxymethylbenzene
CID 15816056
[(1S,2R)-2-[(E)-2-[(1R,2S)-2-(phenylmethoxymethyl)cyclopropyl]ethenyl]cyclopropyl]methanol
CID 100952584
(1S,2S,3S,4R)-2,3-bis(phenylmethoxymethyl)bicyclo[2.1.0]pentane
CID 166976209
(4R,5R)-5-fluoro-3,4-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-ol
CID 138518451
[4-(phenylmethoxymethyl)cyclohexyl]methoxymethylbenzene
CID 100982245
cis-ethyl (1R,2R)-2-(phenylmethoxymethyl)cyclopropane-1-carboxylate
CID 11470338

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol?
The IUPAC name of 2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol (CID 57425831) is 2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol.
What is the SMILES notation for 2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol?
The canonical SMILES for 2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol is OC1CC(COCc2ccccc2)C1F.
What is the InChIKey of 2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol?
The InChIKey is FKJVYPFLGWEKIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FO2/c13-12-10(6-11(12)14)8-15-7-9-4-2-1-3-5-9/h1-5,10-12,14H,6-8H2.
What are the key properties of 2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol?
2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol has a molecular weight of 210.25 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-(phenylmethoxymethyl)cyclobutan-1-ol is sourced from PubChem (CID 57425831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).