1,3-Dehydroadamantane
Basic information
- CAS
24569-89-9- Standard SMILES
C1C2CC34CC1CC3(C2)C4- InChIKey
YNLPLYJBYLQXCY-UHFFFAOYSA-N- Molecular formula
- C10H14
- Average molar mass
- 134.22 g/mol
- Monoisotopic mass
- 134.10955045
Names & identifiers
- Preferred name
- 1,3-Dehydroadamantane
- IUPAC
- tetracyclo[3.3.1.13,7.01,3]decane
Names & synonyms
1,3-Dehydroadamantane24569-89-9Tetracyclo[3.3.1.13,7.01,3]decane1,3-Didehydroadamantane4RDA4M7V9JSCHEMBL23051579DTXSID40179305Tetracyclo[3.3.1.1~3,7~.0~1,3~]decaneTetrahydro-1H,4H-2,5:3a,6a-Dimethanopentalene1H,4H-2,5:3a,6a-Dimethanopentalene, tetrahydro-Q4545676
Database identifiers
- CAS
24569-89-9- PubChem CID
- 141122
- DTXSID
DTXSID40179305- UNII
- 4RDA4M7V9J
- Nikkaji
- J1.009.117I、J570.620C
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 182
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Related reactions
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Compound notes
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