Basic information
- CAS
73713-89-0- Standard SMILES
c1ccc2oc(C3CCCCC3c3nc4ccccc4o3)nc2c1- InChIKey
NPVQPJGYKUGIOZ-UHFFFAOYSA-N- Molecular formula
- C20H18N2O2
- Average molar mass
- 318.4 g/mol
- Monoisotopic mass
- 318.13682782
Names & identifiers
- Preferred name
- 2,2'-(1,2-Cyclohexanediyl)bis(benzoxazole)
- IUPAC
- 2-[2-(1,3-benzoxazol-2-yl)cyclohexyl]-1,3-benzoxazole
- English name
- 2,2'-(Cyclohexane-1,2-diyl)bisbenzoxazole
- Molecular formula
- C20H18N2O2
- Molecular weight
- 318.37
Names & synonyms
73713-89-0RefChem:10588452,2'-(1,2-Cyclohexanediyl)bis(benzoxazole)1,2-Bis(2-benzoxazolyl)cyclohexaneBRN 05675752,2'-Cyclohex-1,2-ylenebisbenzoxazoleCyclohexane, 1,2-bis(2-benzoxazolyl)-BENZOXAZOLE, 2,2'-CYCLOHEX-1,2-YLENEBIS-DTXSID609945922,2'-(Cyclohexane-1,2-diyl)bis(1,3-benzoxazole)2,2'-(Cyclohexane-1,2-diyl)bisbenzoxazoleBenzoxazole, 2,2'-(1,2-cyclohexanediyl)bis-
Database identifiers
- CAS
73713-89-0- PubChem CID
- 52284
- DTXSID
DTXSID60994592- Nikkaji
- J67.908I
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 405
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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