Basic information
- CAS
29515-37-5- Standard SMILES
CCOc1c(OC)cccc1OC- InChIKey
COPJTXDDUKMXHR-UHFFFAOYSA-N- Molecular formula
- C10H14O3
- Average molar mass
- 182.22 g/mol
- Monoisotopic mass
- 182.09429431
Names & identifiers
- Preferred name
- 2-Ethoxy-1,3-dimethoxybenzene
- IUPAC
- 2-ethoxy-1,3-dimethoxybenzene
- English name
- 2-Ethoxy-1,3-dimethoxybenzene
- Molecular formula
- C10H14O3
- Molecular weight
- 182.22
Names & synonyms
2-Ethoxy-1,3-dimethoxybenzeneBenzene, 2-ethoxy-1,3-dimethoxy-29515-37-52,6-Dimethoxyphenetole1,3-dimethoxy-2-ethoxybenzeneSCHEMBL2518861SCHEMBL3156651SCHEMBL7847660DTXSID10335799Benzene 2-ethoxy-1,3-dimethoxy-
Database identifiers
- CAS
29515-37-5- PubChem CID
- 527430
- DTXSID
DTXSID10335799- Nikkaji
- J124.893F
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 126
Physicochemical properties
- Boiling point
- 133 °C · 133 °C(Press: 17 Torr)
- Density
- 1.024 · 1.024±0.06 g/cm3(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
Related reactions
2 records
Compound notes
Loading…