Basic information
- CAS
5451-77-4- Standard SMILES
CC(C)C(=O)Oc1c(Cl)cc(Cl)c(Cl)c1Cl- InChIKey
VBLZPANJGHZOMW-UHFFFAOYSA-N- Molecular formula
- C10H8Cl4O2
- Average molar mass
- 302 g/mol
- Monoisotopic mass
- 299.92784
Names & identifiers
- Preferred name
- 2,3,4,6-Tetrachlorophenyl 2-methylpropanoate
- IUPAC
- (2,3,4,6-tetrachlorophenyl) 2-methylpropanoate
Names & synonyms
2,3,4,6-tetrachlorophenyl 2-methylpropanoate5451-77-4DTXSID20281511RefChem:243937DTXCID80232665NSC21858VBLZPANJGHZOMW-UHFFFAOYSA-NNSC-21858Isobutyric acid, 2,3,4,6-tetrachlorophenyl ester
Database identifiers
- CAS
5451-77-4- PubChem CID
- 228745
- DTXSID
DTXSID20281511
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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