Basic information
- CAS
71823-43-3- Standard SMILES
O=C(O)CC1CC(c2ccccc2)c2ccccc21- InChIKey
SPMZTVMUKNTXEW-UHFFFAOYSA-N- Molecular formula
- C17H16O2
- Average molar mass
- 252.31 g/mol
- Monoisotopic mass
- 252.11502975
Names & identifiers
- Preferred name
- 1-Indanacetic acid, 3-phenyl-
- IUPAC
- 2-(3-phenyl-2,3-dihydro-1H-inden-1-yl)acetic acid
- English name
- 1-Indanacetic acid, 3-phenyl-
- Molecular formula
- C17H16O2
- Molecular weight
- 0
Names & synonyms
71823-43-31-Indanacetic acid, 3-phenyl-RefChem:10556043-Phenyl-1-indanacetic acidCHEMBL3251910SCHEMBL11311531DTXSID20992519SPMZTVMUKNTXEW-UHFFFAOYSA-N(3-PHENYL-2,3-DIHYDRO-1H-INDEN-1-YL)ACETIC ACID
Database identifiers
- CAS
71823-43-3- PubChem CID
- 3054945
- DTXSID
DTXSID20992519- ChEMBL
CHEMBL3251910
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 319
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
1 records
Compound notes
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