Basic information
- CAS
7476-93-9- Standard SMILES
CC(C)(C)c1ccc(OCCOC(=O)CCl)cc1- InChIKey
MSSXJBXAEDJYBU-UHFFFAOYSA-N- Molecular formula
- C14H19ClO3
- Average molar mass
- 270.75 g/mol
- Monoisotopic mass
- 270.1022722
Names & identifiers
- Preferred name
- 2-(4-Tert-butylphenoxy)ethyl 2-chloroacetate
- IUPAC
- 2-(4-tert-butylphenoxy)ethyl 2-chloroacetate
Names & synonyms
2-(4-tert-butylphenoxy)ethyl 2-chloroacetate7476-93-9NSC404415DTXSID10323611NSC-4044152-(4-tert-Butylphenoxy)ethyl chloroacetate
Database identifiers
- CAS
7476-93-9- PubChem CID
- 346249
- DTXSID
DTXSID10323611
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 252
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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