Calcium bis((1)-3-phenyllactate)
Basic information
- CAS
55188-71-1- Standard SMILES
O=C([O-])C(O)Cc1ccccc1.O=C([O-])C(O)Cc1ccccc1.[Ca+2]- InChIKey
OLPHGSKFJSNPOA-UHFFFAOYSA-L- Molecular formula
- C18H18CaO6
- Average molar mass
- 370.4 g/mol
- Monoisotopic mass
- 370.0729291
Names & identifiers
- Preferred name
- Calcium bis((1)-3-phenyllactate)
- IUPAC
- calcium bis(2-hydroxy-3-phenylpropanoate)
Names & synonyms
Calcium bis((1)-3-phenyllactate)EINECS 286-770-085391-17-9SCHEMBL11652275OLPHGSKFJSNPOA-UHFFFAOYSA-LDTXSID901005854Calcium bis(2-hydroxy-3-phenylpropanoate)
Database identifiers
- CAS
55188-71-1、85391-17-9- PubChem CID
- 44152192
- DTXSID
DTXSID901005854- EC Number
- 286-770-0
Properties
Computed structural properties
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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