Basic information
- CAS
80220-33-3- Standard SMILES
O=C(O)C[C@@H]1Cc2ccccc2[C@H]1O- InChIKey
YGRMFAVGMGZPOI-KWQFWETISA-N- Molecular formula
- C11H12O3
- Average molar mass
- 192.21 g/mol
- Monoisotopic mass
- 192.07864424
Names & identifiers
- Preferred name
- 2-[(1S,2S)-1-hydroxy-2,3-dihydro-1H-inden-2-yl]acetic acid
- IUPAC
- 2-[(1S,2S)-1-hydroxy-2,3-dihydro-1H-inden-2-yl]acetic acid
Names & synonyms
NSC6255380220-33-3SCHEMBL11287585NSC-62553
Database identifiers
- CAS
80220-33-3- PubChem CID
- 247604
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 227
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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