2-Butoxyethyl 4-(4-chloro-2-methylphenoxy)butyrate
Basic information
- CAS
94160-35-7- Standard SMILES
CCCCOCCOC(=O)CCCOc1ccc(Cl)cc1C- InChIKey
JTOPPOKWSSPXIO-UHFFFAOYSA-N- Molecular formula
- C17H25ClO4
- Average molar mass
- 328.8 g/mol
- Monoisotopic mass
- 328.144137
Names & identifiers
- Preferred name
- 2-Butoxyethyl 4-(4-chloro-2-methylphenoxy)butyrate
- IUPAC
- 2-butoxyethyl 4-(4-chloro-2-methylphenoxy)butanoate
- English name
- 2-butoxyethyl 4-(4-chloro-2-methylphenoxy)butyrate
- Molecular formula
- C17H25ClO4
- Molecular weight
- 328.83
Names & synonyms
2-Butoxyethyl 4-(4-chloro-2-methylphenoxy)butyrateW2BVB81Q2GUNII-W2BVB81Q2GEINECS 303-319-6DTXSID30240896ETHANOL, 2-BUTOXY-, 4-(4-CHLORO-O-TOLYLOXY)BUTYRATEBUTANOIC ACID, 4-(4-CHLORO-2-METHYLPHENOXY)-, 2-BUTOXYETHYL ESTERRefChem:86007DTXCID60163387303-319-694160-35-72-butoxyethyl 4-(4-chloro-2-methylphenoxy)butanoate
Show more names
4-(4-Chloro-2-methylphenoxy)butyric acid 2-butoxyethyl ester
JTOPPOKWSSPXIO-UHFFFAOYSA-NNS00040199
Database identifiers
- CAS
94160-35-7- PubChem CID
- 3023901
- DTXSID
DTXSID30240896- UNII
- W2BVB81Q2G
- EC Number
- 303-319-6
- Nikkaji
- J368.945J
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 298
Physicochemical properties
- FDA UNII
- 2 BVB81Q2G · W2BVB81Q2G
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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