2,3,4,4a,4b,5,6,7,8,8a-Decahydro-9(1H)-phenanthrenone
Basic information
- CAS
18938-05-1- Standard SMILES
O=C1C=C2CCCCC2C2CCCCC12- InChIKey
JRMDUKMUBDZKCX-UHFFFAOYSA-N- Molecular formula
- C14H20O
- Average molar mass
- 204.31 g/mol
- Monoisotopic mass
- 204.15141526
Names & identifiers
- Preferred name
- 2,3,4,4a,4b,5,6,7,8,8a-Decahydro-9(1H)-phenanthrenone
- IUPAC
- 2,3,4,4a,4b,5,6,7,8,8a-decahydro-1H-phenanthren-9-one
- English name
- 2,3,4,4a,4b,5,6,7,8,8a-Decahydrophenanthren-9(1H)-one
- Molecular weight
- 0
Names & synonyms
2,3,4,4a,4b,5,6,7,8,8a-Decahydro-9(1H)-phenanthrenone18938-05-1DTXSID70336661RefChem:243784DTXCID102877492,3,4,4a,4b,5,6,7,8,8a-decahydro-1H-phenanthren-9-one2,3,4,4a,4b,5,6,7,8,8a-Decahydrophenanthren-9(1H)-oneJRMDUKMUBDZKCX-UHFFFAOYSA-NSCHEMBL277376459(1H)-Phenanthrone, 2,3,4,4a,4b,5,6,7,8,8a-decahydro-AKOS0243258582,3,4,4a,4b,5,6,7,8,8a-Decahydro-9(1H)-phenanthrenone #
Database identifiers
- CAS
18938-05-1- PubChem CID
- 535265
- DTXSID
DTXSID70336661- Nikkaji
- J101.619I
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 302
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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