2-fluoro-3-methylnaphthalen-1-ol

C11H9FO — CID 150732713

IUPAC2-fluoro-3-methylnaphthalen-1-ol
SMILESCc1cc2ccccc2c(O)c1F
InChIInChI=1S/C11H9FO/c1-7-6-8-4-2-3-5-9(8)11(13)10(7)12/h2-6,13H,1H3
InChIKeyJSDZZIDIBLFGID-UHFFFAOYSA-N
MW176.19 g/mol
LogP2.99
Rot. Bonds

About 2-fluoro-3-methylnaphthalen-1-ol

2-fluoro-3-methylnaphthalen-1-ol (PubChem CID 150732713) has the molecular formula C11H9FO and a molecular weight of 176.19 g/mol. Its IUPAC name is 2-fluoro-3-methylnaphthalen-1-ol.

Molecular Properties

Compound Name2-fluoro-3-methylnaphthalen-1-ol
PubChem CID150732713
Molecular FormulaC11H9FO
Molecular Weight176.19 g/mol
Exact Mass176.06
IUPAC Name2-fluoro-3-methylnaphthalen-1-ol
SMILESCc1cc2ccccc2c(O)c1F
InChIInChI=1S/C11H9FO/c1-7-6-8-4-2-3-5-9(8)11(13)10(7)12/h2-6,13H,1H3
InChIKeyJSDZZIDIBLFGID-UHFFFAOYSA-N
XLogP2.99
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.19
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-methylnaphthalen-1-ol?
The IUPAC name of 2-fluoro-3-methylnaphthalen-1-ol (CID 150732713) is 2-fluoro-3-methylnaphthalen-1-ol.
What is the SMILES notation for 2-fluoro-3-methylnaphthalen-1-ol?
The canonical SMILES for 2-fluoro-3-methylnaphthalen-1-ol is Cc1cc2ccccc2c(O)c1F.
What is the InChIKey of 2-fluoro-3-methylnaphthalen-1-ol?
The InChIKey is JSDZZIDIBLFGID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FO/c1-7-6-8-4-2-3-5-9(8)11(13)10(7)12/h2-6,13H,1H3.
What are the key properties of 2-fluoro-3-methylnaphthalen-1-ol?
2-fluoro-3-methylnaphthalen-1-ol has a molecular weight of 176.19 g/mol, XLogP of 2.99, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-methylnaphthalen-1-ol is sourced from PubChem (CID 150732713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).