Methyl 10-chlorophenanthrene-4-carboxylate
Basic information
- CAS
26698-24-8- Standard SMILES
COC(=O)c1cccc2c(Cl)cc3ccccc3c12- InChIKey
DYHLQWMELJNSMP-UHFFFAOYSA-N- Molecular formula
- C16H11ClO2
- Average molar mass
- 270.71 g/mol
- Monoisotopic mass
- 270.0447573
Names & identifiers
- Preferred name
- Methyl 10-chlorophenanthrene-4-carboxylate
- IUPAC
- methyl 10-chlorophenanthrene-4-carboxylate
Names & synonyms
Methyl 10-chlorophenanthrene-4-carboxylate26698-24-8DTXSID20302593RefChem:353418DTXCID10253727DYHLQWMELJNSMP-UHFFFAOYSA-NNSC152013NSC-152013Methyl 10-chloro-4-phenanthrenecarboxylate #
Database identifiers
- CAS
26698-24-8- PubChem CID
- 289764
- DTXSID
DTXSID20302593
Properties
Computed structural properties
- XLogP
- 4.9
- 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
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Compound notes
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