Basic information
- CAS
60307-79-1- Standard SMILES
CC(C#N)OC(=O)/C=C/Oc1ccc(Cl)cc1Cl- InChIKey
SRWHPAWQOPVCQU-SNAWJCMRSA-N- Molecular formula
- C12H9Cl2NO3
- Average molar mass
- 286.11 g/mol
- Monoisotopic mass
- 284.9959485
Names & identifiers
- Preferred name
- 2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 1-cyanoethyl ester
- IUPAC
- 1-cyanoethyl (E)-3-(2,4-dichlorophenoxy)prop-2-enoate
Names & synonyms
2-Propenoic acid, 3-(2,4-dichlorophenoxy)-, 1-cyanoethyl ester60307-79-1
Database identifiers
- CAS
60307-79-1- PubChem CID
- 6443045
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 364
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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