Dodecahydro-9b-boraphenalene
Basic information
- CAS
16664-33-8- Standard SMILES
C1CC2CCCC3CCCC(C1)B23- InChIKey
SKOKKTJRHJQZHK-UHFFFAOYSA-N- Molecular formula
- C12H21B
- Average molar mass
- 176.11 g/mol
- Monoisotopic mass
- 176.1736308
Names & identifiers
- Preferred name
- Dodecahydro-9b-boraphenalene
- IUPAC
- 13-boratricyclo[7.3.1.05,13]tridecane
- English name
- perhydro-9b-boraphenalene
- Molecular formula
- C12H21B
- Molecular weight
- 176.11
Names & synonyms
16664-33-8Zentrobor,IDodecahydro-9b-boraphenalene13-boratricyclo[7.3.1.05,13]tridecane9b-Boraphenalene, dodecahydro-Dodecahydro-9b-boraphenalene #SCHEMBL3791582SCHEMBL10664416DTXSID00937226NS00052615InChI=1/C12H21B/c1-4-10-6-2-8-12-9-3-7-11(5-1)13(10)12/h10-12H,1-9HEinecs 240-707-3
Show more names
perhydro-9b-boraphenaleneDodecahydro-9b-bora-9bH-phenalene
Database identifiers
- CAS
16664-33-8- PubChem CID
- 600472
- EC Number
- 240-707-3
- Nikkaji
- J318.282G
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 144
Related reactions
2 records
Compound notes
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