3-Methyl-9h-fluorene-9-carboxylic acid
Basic information
- CAS
39627-23-1- Standard SMILES
Cc1ccc2c(c1)-c1ccccc1C2C(=O)O- InChIKey
MKENFVCCHTWCRE-UHFFFAOYSA-N- Molecular formula
- C15H12O2
- Average molar mass
- 224.25 g/mol
- Monoisotopic mass
- 224.08372962
Names & identifiers
- Preferred name
- 3-Methyl-9h-fluorene-9-carboxylic acid
- IUPAC
- 3-methyl-9H-fluorene-9-carboxylic acid
Names & synonyms
39627-23-13-methyl-9h-fluorene-9-carboxylic acidNSC86550Oprea1_758278DTXSID80292946NSC-86550
Database identifiers
- CAS
39627-23-1- PubChem CID
- 257928
- DTXSID
DTXSID80292946
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 312
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Compound notes
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