Basic information
- CAS
5076-72-2- Standard SMILES
CCOc1ccc(OC)cc1- InChIKey
FTFNFGIOGXKJSP-UHFFFAOYSA-N- Molecular formula
- C9H12O2
- Average molar mass
- 152.19 g/mol
- Monoisotopic mass
- 152.08372962
Names & identifiers
- Preferred name
- p-Methoxyphenetole
- IUPAC
- 1-ethoxy-4-methoxybenzene
- English name
- p-methoxyphenetole
- Molecular formula
- C9H12O2
- Molecular weight
- 152.19038
Names & synonyms
1-Ethoxy-4-methoxybenzenep-Ethoxyanisolep-Methoxyphenetole5076-72-24-EthoxyanisoleBenzene, 1-ethoxy-4-methoxy-Ethyl p-methoxyphenyl etherEINECS 225-786-4I9389X2T25DTXSID60198795RefChem:858122DTXCID20121286
Show more names
225-786-41-methoxy-4-ethoxybenzeneUNII-I9389X2T251-ethoxy-4-methoxy-benzene1-Ethoxy-4-methoxybenzene #SCHEMBL354673SCHEMBL354674SCHEMBL535984
Database identifiers
- CAS
5076-72-2- PubChem CID
- 78760
- DTXSID
DTXSID60198795- ChEMBL
CHEMBL2252609- UNII
- I9389X2T25
- EC Number
- 225-786-4
- Nikkaji
- J80.948I
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 95.7
Experimental & physicochemical properties
Flavoring AgentsEU Flavoring substances
Physicochemical properties
- FLAVIS Number
- 4.068 · 04.068 | 1-Ethoxy-4-methoxybenzene
- LogP
- 2.563 · 2.563 (est)
- FDA UNII
- 9389 X2T25 · I9389X2T25
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
Benzene, 1-ethoxy-4-methoxy-: Does not have an individual approval but may be used under an appropriate group standard
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
BOC Sciences[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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