1-Allyl-2,3,4-trimethoxybenzene
Basic information
- CAS
5273-88-1- Standard SMILES
C=CCc1ccc(OC)c(OC)c1OC- InChIKey
VZNVINHATUJPSB-UHFFFAOYSA-N- Molecular formula
- C12H16O3
- Average molar mass
- 208.25 g/mol
- Monoisotopic mass
- 208.10994437
Names & identifiers
- Preferred name
- 1-Allyl-2,3,4-trimethoxybenzene
- IUPAC
- 1,2,3-trimethoxy-4-prop-2-enylbenzene
Names & synonyms
1-Allyl-2,3,4-trimethoxybenzene5273-88-1Benzene, 1-allyl-2,3,4-trimethoxy-1,2,3-trimethoxy-4-(prop-2-en-1-yl)benzeneDTXSID902007141,2,3-Trimethoxy-4-(2-propen-1-yl)benzeneBenzene, 1,2,3-trimethoxy-4-(2-propen-1-yl)-
Database identifiers
- CAS
5273-88-1- PubChem CID
- 3014352
- DTXSID
DTXSID90200714- Nikkaji
- J510.877B
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…