[3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol

C15H15FO3 — CID 102939888

IUPAC[3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol
SMILESOCc1cc(F)cc(OCOCc2ccccc2)c1
InChIInChI=1S/C15H15FO3/c16-14-6-13(9-17)7-15(8-14)19-11-18-10-12-4-2-1-3-5-12/h1-8,17H,9-11H2
InChIKeyPDBZACOKFNJGEX-UHFFFAOYSA-N
MW262.28 g/mol
LogP2.87
Rot. Bonds6

About [3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol

[3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol (PubChem CID 102939888) has the molecular formula C15H15FO3 and a molecular weight of 262.28 g/mol. Its IUPAC name is [3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol
PubChem CID102939888
Molecular FormulaC15H15FO3
Molecular Weight262.28 g/mol
Exact Mass262.10
IUPAC Name[3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol
SMILESOCc1cc(F)cc(OCOCc2ccccc2)c1
InChIInChI=1S/C15H15FO3/c16-14-6-13(9-17)7-15(8-14)19-11-18-10-12-4-2-1-3-5-12/h1-8,17H,9-11H2
InChIKeyPDBZACOKFNJGEX-UHFFFAOYSA-N
XLogP2.87
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.28
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

[3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanamine
CID 102939558
[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methanol
CID 15385707
1-bromo-3-fluoro-5-phenylmethoxybenzene;phenylmethanol
CID 70121150
1,3-dimethyl-5-(phenylmethoxymethoxy)benzene
CID 102940828
1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene
CID 118070659
(1R)-1-[2-fluoro-4-(phenylmethoxymethoxy)phenyl]ethanol
CID 107720224
3-[[3-[[3-[[3-(hydroxymethyl)-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenol
CID 101175071
[3-fluoro-2-(phenylmethoxymethoxy)phenyl]methanol
CID 102939875
4-(phenylmethoxymethoxy)benzoic acid
CID 102939337
3-fluoro-5-phenylmethoxybenzoic acid
CID 18971714
[3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol
CID 114850200
(3-fluoro-5-methoxyphenyl)methanol
CID 26985456

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol?
The IUPAC name of [3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol (CID 102939888) is [3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol.
What is the SMILES notation for [3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol?
The canonical SMILES for [3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol is OCc1cc(F)cc(OCOCc2ccccc2)c1.
What is the InChIKey of [3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol?
The InChIKey is PDBZACOKFNJGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FO3/c16-14-6-13(9-17)7-15(8-14)19-11-18-10-12-4-2-1-3-5-12/h1-8,17H,9-11H2.
What are the key properties of [3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol?
[3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol has a molecular weight of 262.28 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-5-(phenylmethoxymethoxy)phenyl]methanol is sourced from PubChem (CID 102939888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).