2-[2-[4-(2-Benzoxazolyl)phenyl]ethenyl]-5-methylbenzoxazole
Basic information
- CAS
3788-66-7- Standard SMILES
Cc1ccc2oc(C=Cc3ccc(-c4nc5ccccc5o4)cc3)nc2c1- InChIKey
KKDLKBVEHOJWKX-UHFFFAOYSA-N- Molecular formula
- C23H16N2O2
- Average molar mass
- 352.4 g/mol
- Monoisotopic mass
- 352.12117776
Names & identifiers
- Preferred name
- 2-[2-[4-(2-Benzoxazolyl)phenyl]ethenyl]-5-methylbenzoxazole
- IUPAC
- 2-[2-[4-(1,3-benzoxazol-2-yl)phenyl]ethenyl]-5-methyl-1,3-benzoxazole
Names & synonyms
3788-66-72-[2-[4-(BENZOXAZOL-2-YL)PHENYL]VINYL]-5-METHYLBENZOXAZOLE2-[2-[4-(2-Benzoxazolyl)phenyl]ethenyl]-5-methylbenzoxazoleDTXSID0011878432-{2-[4-(1,3-BENZOXAZOL-2-YL)PHENYL]ETHENYL}-5-METHYL-1,3-BENZOXAZOLE
Database identifiers
- CAS
3788-66-7- PubChem CID
- 107465
- DTXSID
DTXSID001187843- EC Number
- 223-258-8
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 530
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…