Basic information
- CAS
105417-32-1- Standard SMILES
COC(=O)c1ccc([Se]c2ccccc2)cc1- InChIKey
JOPQGGFVOYHPER-UHFFFAOYSA-N- Molecular formula
- C14H12O2Se
- Average molar mass
- 291.21 g/mol
- Monoisotopic mass
- 292.00025
Names & identifiers
- Preferred name
- Benzoic acid, 4-(phenylseleno)-, methyl ester
- IUPAC
- methyl 4-phenylselanylbenzoate
Names & synonyms
Benzoic acid, 4-(phenylseleno)-, methyl ester105417-32-1DTXSID90464157RefChem:327500DTXCID50414976METHYL 4-(PHENYLSELANYL)BENZOATESCHEMBL5887875
Database identifiers
- CAS
105417-32-1- PubChem CID
- 11380751
- DTXSID
DTXSID90464157- Nikkaji
- J1.852.067B
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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