3-[(2-fluorophenyl)methoxy]propan-1-ol

C10H13FO2 — CID 23325115

IUPAC3-[(2-fluorophenyl)methoxy]propan-1-ol
SMILESOCCCOCc1ccccc1F
InChIInChI=1S/C10H13FO2/c11-10-5-2-1-4-9(10)8-13-7-3-6-12/h1-2,4-5,12H,3,6-8H2
InChIKeyYEYSOEFOGRDVJM-UHFFFAOYSA-N
MW184.21 g/mol
LogP1.72
Rot. Bonds5

About 3-[(2-fluorophenyl)methoxy]propan-1-ol

3-[(2-fluorophenyl)methoxy]propan-1-ol (PubChem CID 23325115) has the molecular formula C10H13FO2 and a molecular weight of 184.21 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)methoxy]propan-1-ol.

Molecular Properties

Compound Name3-[(2-fluorophenyl)methoxy]propan-1-ol
PubChem CID23325115
Molecular FormulaC10H13FO2
Molecular Weight184.21 g/mol
Exact Mass184.09
IUPAC Name3-[(2-fluorophenyl)methoxy]propan-1-ol
SMILESOCCCOCc1ccccc1F
InChIInChI=1S/C10H13FO2/c11-10-5-2-1-4-9(10)8-13-7-3-6-12/h1-2,4-5,12H,3,6-8H2
InChIKeyYEYSOEFOGRDVJM-UHFFFAOYSA-N
XLogP1.72
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.21
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-fluoro-2-[(2-fluorophenyl)methoxymethyl]benzene
CID 67509440
3-[(2-ethenylphenyl)methoxy]propan-1-ol
CID 22406179
1-fluoro-2-(3-methylbutoxymethyl)benzene
CID 91704397
2-fluoro-3-(3-hydroxypropoxymethyl)benzoic acid
CID 107119719
N-[4-[(2-fluorophenyl)methoxy]butyl]cyclopropanamine
CID 63935145
5-[(2-fluorophenyl)methoxy]-N-propylpentan-1-amine
CID 63937972
N-ethyl-5-[(2-fluorophenyl)methoxy]pentan-2-amine
CID 63935925
1-fluoro-2-[(2-fluorophenyl)methoxymethyl]benzene;N-propan-2-ylidenehydroxylamine
CID 174820593
1-(4-fluorophenyl)-3-[(2-fluorophenyl)methoxy]propan-1-one
CID 63935532
ethyl 3-[(2-fluorophenyl)methoxy]propanoate
CID 63931594
1-fluoro-2-(methoxymethoxymethyl)benzene
CID 10920940
3-[2-fluoro-6-(hydroxymethyl)phenoxy]propan-1-ol
CID 112612921

Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluorophenyl)methoxy]propan-1-ol?
The IUPAC name of 3-[(2-fluorophenyl)methoxy]propan-1-ol (CID 23325115) is 3-[(2-fluorophenyl)methoxy]propan-1-ol.
What is the SMILES notation for 3-[(2-fluorophenyl)methoxy]propan-1-ol?
The canonical SMILES for 3-[(2-fluorophenyl)methoxy]propan-1-ol is OCCCOCc1ccccc1F.
What is the InChIKey of 3-[(2-fluorophenyl)methoxy]propan-1-ol?
The InChIKey is YEYSOEFOGRDVJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO2/c11-10-5-2-1-4-9(10)8-13-7-3-6-12/h1-2,4-5,12H,3,6-8H2.
What are the key properties of 3-[(2-fluorophenyl)methoxy]propan-1-ol?
3-[(2-fluorophenyl)methoxy]propan-1-ol has a molecular weight of 184.21 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)methoxy]propan-1-ol is sourced from PubChem (CID 23325115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).