1-(4-fluoro-3-methoxyphenyl)nonan-1-ol

C16H25FO2 — CID 115783950

IUPAC1-(4-fluoro-3-methoxyphenyl)nonan-1-ol
SMILESCCCCCCCCC(O)c1ccc(F)c(OC)c1
InChIInChI=1S/C16H25FO2/c1-3-4-5-6-7-8-9-15(18)13-10-11-14(17)16(12-13)19-2/h10-12,15,18H,3-9H2,1-2H3
InChIKeyUOLMJOJYMZYGKZ-UHFFFAOYSA-N
MW268.37 g/mol
LogP4.62
Rot. Bonds9

About 1-(4-fluoro-3-methoxyphenyl)nonan-1-ol

1-(4-fluoro-3-methoxyphenyl)nonan-1-ol (PubChem CID 115783950) has the molecular formula C16H25FO2 and a molecular weight of 268.37 g/mol. Its IUPAC name is 1-(4-fluoro-3-methoxyphenyl)nonan-1-ol.

Molecular Properties

Compound Name1-(4-fluoro-3-methoxyphenyl)nonan-1-ol
PubChem CID115783950
Molecular FormulaC16H25FO2
Molecular Weight268.37 g/mol
Exact Mass268.18
IUPAC Name1-(4-fluoro-3-methoxyphenyl)nonan-1-ol
SMILESCCCCCCCCC(O)c1ccc(F)c(OC)c1
InChIInChI=1S/C16H25FO2/c1-3-4-5-6-7-8-9-15(18)13-10-11-14(17)16(12-13)19-2/h10-12,15,18H,3-9H2,1-2H3
InChIKeyUOLMJOJYMZYGKZ-UHFFFAOYSA-N
XLogP4.62
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.37
LogP ≤ 54.62
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-(3-fluoro-4-methoxyphenyl)undecan-1-ol
CID 65151223
1-(4-fluoro-3-methoxyphenyl)decan-1-amine
CID 115831321
4-(1-hydroxyheptyl)-2-methoxyphenol
CID 14035097
1-(4-fluoro-3-methoxyphenyl)octylhydrazine
CID 105293533
1-(4-chloro-3-methoxyphenyl)decan-1-ol
CID 115817958
1-(4-chloro-3-methoxyphenyl)octan-1-ol
CID 79697126
5-(1-hydroxydodecyl)-2-methoxyphenol
CID 139789005
1-(4-methoxy-3-methylphenyl)decan-1-ol
CID 65148116
1-(3-chloro-4-fluorophenyl)nonan-1-ol
CID 63414052
1,6-bis(3,4-dimethoxyphenyl)hexane-1,6-diol
CID 118987415
1-(4-fluoro-3-methoxyphenyl)pentylhydrazine
CID 105293751
3-cyclopropyl-1-(4-fluoro-3-methoxyphenyl)propan-1-ol
CID 115810701

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-3-methoxyphenyl)nonan-1-ol?
The IUPAC name of 1-(4-fluoro-3-methoxyphenyl)nonan-1-ol (CID 115783950) is 1-(4-fluoro-3-methoxyphenyl)nonan-1-ol.
What is the SMILES notation for 1-(4-fluoro-3-methoxyphenyl)nonan-1-ol?
The canonical SMILES for 1-(4-fluoro-3-methoxyphenyl)nonan-1-ol is CCCCCCCCC(O)c1ccc(F)c(OC)c1.
What is the InChIKey of 1-(4-fluoro-3-methoxyphenyl)nonan-1-ol?
The InChIKey is UOLMJOJYMZYGKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FO2/c1-3-4-5-6-7-8-9-15(18)13-10-11-14(17)16(12-13)19-2/h10-12,15,18H,3-9H2,1-2H3.
What are the key properties of 1-(4-fluoro-3-methoxyphenyl)nonan-1-ol?
1-(4-fluoro-3-methoxyphenyl)nonan-1-ol has a molecular weight of 268.37 g/mol, XLogP of 4.62, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-3-methoxyphenyl)nonan-1-ol is sourced from PubChem (CID 115783950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).