Ro 2-7239
Basic information
- CAS
2327-61-9- Standard SMILES
CC(=O)C1CCC2C(CCC3=CC(=O)CCC32)C1- InChIKey
FZBFFQIUPYHEAP-UHFFFAOYSA-N- Molecular formula
- C16H22O2
- Average molar mass
- 246.34 g/mol
- Monoisotopic mass
- 246.16197994
Overview
structure
Names & identifiers
- Preferred name
- Ro 2-7239
- IUPAC
- 7-acetyl-4,4a,4b,5,6,7,8,8a,9,10-decahydro-3H-phenanthren-2-one
Names & synonyms
Ro 2-72392327-61-97-Acetyl-4,4a,4b,5,6,7,8,8a,9,10-decahydro-2(3H)-phenanthroneRefChem:179635MLS0026389817-acetyl-4,4a,4b,5,6,7,8,8a,9,10-decahydrophenanthren-2(3h)-oneNSC24230NSC 24230CHEMBL1903072SCHEMBL30291857DTXSID30945955HMS3093D09
Show more names
NSC-242302(3H)-Phenanthrenone, 7-acetyl-4,4a,4b,5,6,7,8,8a,9,10-decahydro-2(3H)-Phenanthrone, 7-acetyl-4,4a,4b,5,6,7,8,8a,9,10-decahydro-SMR0015484412(3H)-Phenanthrone,4a,4b,5,6,7,8,8a,9,10-decahydro-2(3H)-Phenanthrenone,4a,4b,5,6,7,8,8a,9,10-decahydro-
Database identifiers
- CAS
2327-61-9- PubChem CID
- 95219
- DTXSID
DTXSID30945955- ChEMBL
CHEMBL1903072
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 407
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Related reactions
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Compound notes
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