Oxazole, 4,5-dihydro-2-(2-(3,4-dichlorophenyl)ethenyl)-4,4-dimethyl-, hydrochloride, (E)-
Basic information
- CAS
100098-74-6- Standard SMILES
CC1(C)COC(/C=C/c2ccc(Cl)c(Cl)c2)=N1.Cl- InChIKey
SZOXXJJUIIDFGC-CVDVRWGVSA-N- Molecular formula
- C13H14Cl3NO
- Average molar mass
- 306.6 g/mol
- Monoisotopic mass
- 305.014097
Names & identifiers
- Preferred name
- Oxazole, 4,5-dihydro-2-(2-(3,4-dichlorophenyl)ethenyl)-4,4-dimethyl-, hydrochloride, (E)-
- IUPAC
- 2-[(E)-2-(3,4-dichlorophenyl)ethenyl]-4,4-dimethyl-5H-1,3-oxazole;hydrochloride
Names & synonyms
100098-74-6Oxazole, 4,5-dihydro-2-(2-(3,4-dichlorophenyl)ethenyl)-4,4-dimethyl-, hydrochloride, (E)-RefChem:1094012(E)-2-(3,4-Dichlorostyryl)-4,4-dimethyl-2-oxazoline hydrochloride(E)-4,5-Dihydro-2-(2-(3,4-dichlorophenyl)ethenyl)-4,4-dimethyloxazole hydrochloride
Database identifiers
- CAS
100098-74-6- PubChem CID
- 6447769
Properties
Computed structural properties
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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