Basic information
- CAS
116401-67-3- Standard SMILES
Cc1ccccc1C1=C(C2CCCc3ccccc32)CCc2ccccc21- InChIKey
IOWBIFKDPCQQNP-UHFFFAOYSA-N- Molecular formula
- C27H26
- Average molar mass
- 350.5 g/mol
- Monoisotopic mass
- 350.20345083
Names & identifiers
- Preferred name
- 1'-(2-Methylphenyl)-1,2,3,3',4,4'-hexahydro-1,2'-binaphthalene
- IUPAC
- 4-(2-methylphenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-dihydronaphthalene
Names & synonyms
DTXSID4011771131'-(2-Methylphenyl)-1,2,3,3',4,4'-hexahydro-1,2'-binaphthalene1,2,3,3a(2),4,4a(2)-Hexahydro-1a(2)-(2-methylphenyl)-1,2a(2)-binaphthalene116401-67-3
Database identifiers
- CAS
116401-67-3- PubChem CID
- 85563503
- DTXSID
DTXSID401177113
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 542
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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