5,5'-(1,3-Propanediyl)bisisoxozole
Basic information
- CAS
37704-51-1- Standard SMILES
c1cc(CCCc2ccno2)on1- InChIKey
GKAZHGXJGCPBJP-UHFFFAOYSA-N- Molecular formula
- C9H10N2O2
- Average molar mass
- 178.19 g/mol
- Monoisotopic mass
- 178.07422757
Names & identifiers
- Preferred name
- 5,5'-(1,3-Propanediyl)bisisoxozole
- IUPAC
- 5-[3-(1,2-oxazol-5-yl)propyl]-1,2-oxazole
- English name
- 5,5'-(1,3-Propanediyl)bisisoxazole
- Molecular formula
- C9H10N2O2
- Molecular weight
- 178.19
Names & synonyms
5,5'-(1,3-PROPANEDIYL)BISISOXOZOLE37704-51-1DTXSID40191143RefChem:298130DTXCID50113634Isoxazole, 5,5'-(1,3-propanediyl)bis-GKAZHGXJGCPBJP-UHFFFAOYSA-N5-[3-(5-Isoxazolyl)propyl]isoxazole #5,5'-(Propane-1,3-diyl)bis(1,2-oxazole)5,5'-(1,3-Propanediyl)bisisoxazole5,5'-propane-1,3-diyl-bis-isoxazole
Database identifiers
- CAS
37704-51-1- PubChem CID
- 37819
- DTXSID
DTXSID40191143- Nikkaji
- J122.051I
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 139
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Compound notes
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