Methyl 9,10-dibromo-9,10-dihydrophenanthrene-1-carboxylate
Basic information
- CAS
26847-77-8- Standard SMILES
COC(=O)c1cccc2c1C(Br)C(Br)c1ccccc1-2- InChIKey
AJQDBWJDAAGAED-UHFFFAOYSA-N- Molecular formula
- C16H12Br2O2
- Average molar mass
- 396.07 g/mol
- Monoisotopic mass
- 393.9204
Names & identifiers
- Preferred name
- Methyl 9,10-dibromo-9,10-dihydrophenanthrene-1-carboxylate
- IUPAC
- methyl 9,10-dibromo-9,10-dihydrophenanthrene-1-carboxylate
Names & synonyms
Methyl 9,10-dibromo-9,10-dihydrophenanthrene-1-carboxylate26847-77-8DTXSID50301135RefChem:356470DTXCID00252269NSC141338AJQDBWJDAAGAED-UHFFFAOYSA-N1-Phenanthrenecarboxylicacid, 9,10-dibromo-9,10-dihydro-, methyl esterNSC-141338SY568987DS-003145Methyl 9,10-dibromo-9,10-dihydro-1-phenanthrenecarboxylate #
Database identifiers
- CAS
26847-77-8- PubChem CID
- 284941
- DTXSID
DTXSID50301135
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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