methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate

C15H11FO3 — CID 14579585

IUPACmethyl 2-fluoro-9-hydroxyfluorene-9-carboxylate
SMILESCOC(=O)C1(O)c2ccccc2-c2ccc(F)cc21
InChIInChI=1S/C15H11FO3/c1-19-14(17)15(18)12-5-3-2-4-10(12)11-7-6-9(16)8-13(11)15/h2-8,18H,1H3
InChIKeySVGBXZSVEIPVDN-UHFFFAOYSA-N
MW258.25 g/mol
LogP2.21
Rot. Bonds1

About methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate

methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate (PubChem CID 14579585) has the molecular formula C15H11FO3 and a molecular weight of 258.25 g/mol. Its IUPAC name is methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate.

Molecular Properties

Compound Namemethyl 2-fluoro-9-hydroxyfluorene-9-carboxylate
PubChem CID14579585
Molecular FormulaC15H11FO3
Molecular Weight258.25 g/mol
Exact Mass258.07
IUPAC Namemethyl 2-fluoro-9-hydroxyfluorene-9-carboxylate
SMILESCOC(=O)C1(O)c2ccccc2-c2ccc(F)cc21
InChIInChI=1S/C15H11FO3/c1-19-14(17)15(18)12-5-3-2-4-10(12)11-7-6-9(16)8-13(11)15/h2-8,18H,1H3
InChIKeySVGBXZSVEIPVDN-UHFFFAOYSA-N
XLogP2.21
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.25
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate?
The IUPAC name of methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate (CID 14579585) is methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate.
What is the SMILES notation for methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate?
The canonical SMILES for methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate is COC(=O)C1(O)c2ccccc2-c2ccc(F)cc21.
What is the InChIKey of methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate?
The InChIKey is SVGBXZSVEIPVDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FO3/c1-19-14(17)15(18)12-5-3-2-4-10(12)11-7-6-9(16)8-13(11)15/h2-8,18H,1H3.
What are the key properties of methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate?
methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate has a molecular weight of 258.25 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-fluoro-9-hydroxyfluorene-9-carboxylate is sourced from PubChem (CID 14579585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).