Methyl 10-bromophenanthrene-4-carboxylate
Basic information
- CAS
26698-23-7- Standard SMILES
COC(=O)c1cccc2c(Br)cc3ccccc3c12- InChIKey
QAAWHGLORDSRCA-UHFFFAOYSA-N- Molecular formula
- C16H11BrO2
- Average molar mass
- 315.16 g/mol
- Monoisotopic mass
- 313.99424
Names & identifiers
- Preferred name
- Methyl 10-bromophenanthrene-4-carboxylate
- IUPAC
- methyl 10-bromophenanthrene-4-carboxylate
Names & synonyms
Methyl 10-bromophenanthrene-4-carboxylate26698-23-7DTXSID60302572RefChem:353414DTXCID50253706QAAWHGLORDSRCA-UHFFFAOYSA-NNSC151926NSC-151926Methyl 10-bromo-4-phenanthrenecarboxylate #
Database identifiers
- CAS
26698-23-7- PubChem CID
- 289722
- DTXSID
DTXSID60302572
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 344
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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