Phentolacin
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Basic information
- CAS
7443-17-6- Standard SMILES
Cc1ccc(C(C(=O)C2C(=O)c3ccccc3C2=O)c2ccccc2)cc1- InChIKey
DJQWSIGATNDGBR-UHFFFAOYSA-N- Molecular formula
- C24H18O3
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 354.12559443
Names & identifiers
- Preferred name
- Phentolacin
- IUPAC
- 2-[2-(4-methylphenyl)-2-phenylacetyl]indene-1,3-dione
- English name
- phentolacin
- Molecular formula
- C24H18O3
- Molecular weight
- 354.39792
Names & synonyms
Phentolacin7443-17-62-((4-Methylphenyl)phenylacetyl)-1H-indene-1,3(2H)-dioneRefChem:172924DTXSID509959571,3-Indandione, 2-(alpha-phenyl-alpha-(p-tolyl))acetyl-1H-Inden-1,3(2H)-dione, 2-((4-methylphenyl)phenylacetyl)-2-[(4-Methylphenyl)(phenyl)acetyl]-1H-indene-1,3(2H)-dione
Database identifiers
- CAS
7443-17-6- PubChem CID
- 160895
- DTXSID
DTXSID50995957
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 556
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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