Basic information
- Standard SMILES
BrC12CC3CC(CC(C3)C1=C1C3CC4CC(C3)CC1C4)C2- InChIKey
LPQGPMVOHZXUIK-UHFFFAOYSA-N- Molecular formula
- C20H27Br
- Average molar mass
- 347.3 g/mol
Names & identifiers
- Preferred name
- Bromoadamantylideneadamantane
- IUPAC
- 2-(2-adamantylidene)-1-bromoadamantane
Names & synonyms
bromoadamantylideneadamantanebromoadamantylidene adamantaneSCHEMBL11118033LPQGPMVOHZXUIK-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 70517409
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 486
Related reactions
3 records
Compound notes
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