Basic information
- CAS
2287-32-3- Standard SMILES
COc1ccccc1OCCOCCCl- InChIKey
ISMZWFQULKRSSN-UHFFFAOYSA-N- Molecular formula
- C11H15ClO3
- Average molar mass
- 230.69 g/mol
- Monoisotopic mass
- 230.070972
Names & identifiers
- Preferred name
- 1-[2-(2-Chloroethoxy)ethoxy]-2-methoxybenzene
- IUPAC
- 1-[2-(2-chloroethoxy)ethoxy]-2-methoxybenzene
- English name
- 1-[2-(2-chloroethoxy)ethoxy]-2-methoxybenzene
- Molecular formula
- C11H15ClO3
- Molecular weight
- 230.69
Names & synonyms
1-[2-(2-chloroethoxy)ethoxy]-2-methoxybenzene2287-32-3EINECS 218-927-61-(2-(2-Chloroethoxy)ethoxy)-2-methoxybenzeneDTXSID00177408RefChem:74023DTXCID2099899218-927-6XSK4SNM3ZGSCHEMBL30862625ISMZWFQULKRSSN-UHFFFAOYSA-NAKOS012975639
Show more names
NS00027280Benzene, 1-[2-(2-chloroethoxy)ethoxy]-2-methoxy-
Database identifiers
- CAS
2287-32-3- PubChem CID
- 75296
- DTXSID
DTXSID00177408- UNII
- XSK4SNM3ZG
- EC Number
- 218-927-6
- Nikkaji
- J213.165J
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 155
Physicochemical properties
- Melting point
- 31 · 31-32 °C
- Boiling point
- 124 °C · 124 °C
- Density
- 1.126 · 1.126±0.06 g/cm3(Predicted)
- FDA UNII
- 4 SNM3ZG · XSK4SNM3ZG
Chemistry & industry
Suppliers2 total
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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