Basic information
- CAS
946-88-3- Standard SMILES
O=C(COc1ccccc1)OCCCl- InChIKey
DOHMOKZZEYNNHH-UHFFFAOYSA-N- Molecular formula
- C10H11ClO3
- Average molar mass
- 214.64 g/mol
- Monoisotopic mass
- 214.0396719
Names & identifiers
- Preferred name
- Acetic acid, phenoxy-, 2-chloroethyl ester
- IUPAC
- 2-chloroethyl 2-phenoxyacetate
- English name
- Phenoxyacetic acid 2-chloroethyl ester
- Molecular formula
- C10H11ClO3
- Molecular weight
- 214.65
Names & synonyms
2-chloroethyl 2-phenoxyacetate946-88-3ACETIC ACID, PHENOXY-, 2-CHLOROETHYL ESTERNSC-7000RV3VUV9ST3DTXSID40241551RefChem:1075831DTXCID701640422-Chloroethyl phenoxyacetateNSC 7000BRN 1961643WLN: G2OV1OR
Show more names
Phenoxyacetic acid 2-chloroethyl esterPhenoxyessigsaeure-(2-chlor-ethylester)
NSC7000DS-004005Acetic acid, 2-phenoxy-, 2-chloroethyl ester
Database identifiers
- CAS
946-88-3- PubChem CID
- 13686
- DTXSID
DTXSID40241551- UNII
- RV3VUV9ST3
- Nikkaji
- J54.957F
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 167
Physicochemical properties
- Boiling point
- 308.11 °C · 308.11°C (rough estimate)
- Density
- 1.2413 · 1.2413 (rough estimate)
- refractive index
- 1.539 · 1.5390 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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