9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid

C15H12O3 — CID 138711693

IUPAC9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid
SMILESCc1cc(C(=O)O)cc2c1-c1ccccc1C2O
InChIInChI=1S/C15H12O3/c1-8-6-9(15(17)18)7-12-13(8)10-4-2-3-5-11(10)14(12)16/h2-7,14,16H,1H3,(H,17,18)
InChIKeyQTIFTQPDZVSCEB-UHFFFAOYSA-N
MW240.26 g/mol
LogP2.76
Rot. Bonds1

About 9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid

9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid (PubChem CID 138711693) has the molecular formula C15H12O3 and a molecular weight of 240.26 g/mol. Its IUPAC name is 9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid.

Molecular Properties

Compound Name9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid
PubChem CID138711693
Molecular FormulaC15H12O3
Molecular Weight240.26 g/mol
Exact Mass240.08
IUPAC Name9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid
SMILESCc1cc(C(=O)O)cc2c1-c1ccccc1C2O
InChIInChI=1S/C15H12O3/c1-8-6-9(15(17)18)7-12-13(8)10-4-2-3-5-11(10)14(12)16/h2-7,14,16H,1H3,(H,17,18)
InChIKeyQTIFTQPDZVSCEB-UHFFFAOYSA-N
XLogP2.76
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid?
The IUPAC name of 9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid (CID 138711693) is 9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid.
What is the SMILES notation for 9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid?
The canonical SMILES for 9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid is Cc1cc(C(=O)O)cc2c1-c1ccccc1C2O.
What is the InChIKey of 9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid?
The InChIKey is QTIFTQPDZVSCEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12O3/c1-8-6-9(15(17)18)7-12-13(8)10-4-2-3-5-11(10)14(12)16/h2-7,14,16H,1H3,(H,17,18).
What are the key properties of 9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid?
9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid has a molecular weight of 240.26 g/mol, XLogP of 2.76, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hydroxy-4-methyl-9H-fluorene-2-carboxylic acid is sourced from PubChem (CID 138711693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).