9H-fluorene-3-carboxylic acid

C14H10O2 — CID 7131748

IUPAC9H-fluorene-3-carboxylic acid
SMILESO=C(O)c1ccc2c(c1)-c1ccccc1C2
InChIInChI=1S/C14H10O2/c15-14(16)11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-6,8H,7H2,(H,15,16)
InChIKeyWYRSPZVTTMUNBL-UHFFFAOYSA-N
MW210.23 g/mol
LogP2.96
Rot. Bonds1

About 9H-fluorene-3-carboxylic acid

9H-fluorene-3-carboxylic acid (PubChem CID 7131748) has the molecular formula C14H10O2 and a molecular weight of 210.23 g/mol. Its IUPAC name is 9H-fluorene-3-carboxylic acid.

Molecular Properties

Compound Name9H-fluorene-3-carboxylic acid
PubChem CID7131748
Molecular FormulaC14H10O2
Molecular Weight210.23 g/mol
Exact Mass210.07
IUPAC Name9H-fluorene-3-carboxylic acid
SMILESO=C(O)c1ccc2c(c1)-c1ccccc1C2
InChIInChI=1S/C14H10O2/c15-14(16)11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-6,8H,7H2,(H,15,16)
InChIKeyWYRSPZVTTMUNBL-UHFFFAOYSA-N
XLogP2.96
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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(1,1'-Biphenyl)-4-carboxylic acid
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CID 6847
2,6-Naphthalenedicarboxylic acid
CID 14357
4-Ethylbenzoic Acid
CID 12086
3,4-Dimethylbenzoic acid
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Benzoic acid, 2-((1,1'-biphenyl)-4-ylcarbonyl)-
CID 39302
2-Naphthoic acid
CID 7123

Frequently Asked Questions

What is the IUPAC name of 9H-fluorene-3-carboxylic acid?
The IUPAC name of 9H-fluorene-3-carboxylic acid (CID 7131748) is 9H-fluorene-3-carboxylic acid.
What is the SMILES notation for 9H-fluorene-3-carboxylic acid?
The canonical SMILES for 9H-fluorene-3-carboxylic acid is O=C(O)c1ccc2c(c1)-c1ccccc1C2.
What is the InChIKey of 9H-fluorene-3-carboxylic acid?
The InChIKey is WYRSPZVTTMUNBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10O2/c15-14(16)11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-6,8H,7H2,(H,15,16).
What are the key properties of 9H-fluorene-3-carboxylic acid?
9H-fluorene-3-carboxylic acid has a molecular weight of 210.23 g/mol, XLogP of 2.96, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluorene-3-carboxylic acid is sourced from PubChem (CID 7131748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).