Basic information
- CAS
57342-02-6- Standard SMILES
CCc1ccc(OCCC(CC)CCC2OC2(C)CC)cc1- InChIKey
YHDXOFFTMOZZPE-UHFFFAOYSA-N- Molecular formula
- C20H32O2
- Average molar mass
- 304.5 g/mol
- Monoisotopic mass
- 304.24023026
Overview
similar to ethylphenylepoxygeranyl ether; structure
Names & identifiers
- Preferred name
- Epofenonane
- IUPAC
- 2-ethyl-3-[3-ethyl-5-(4-ethylphenoxy)pentyl]-2-methyloxirane
- English name
- 6,7-Epoxy-3-ethyl-1-(4-ethylphenoxy)-7-methylnonane
- Molecular formula
- C20H32O2
- Molecular weight
- 304.47
Names & synonyms
Epofenonane57342-02-68I82W3V5ZYDTXSID7041912RO-10-3108ACR-20196,7-Epoxy-1-(p-ethylphenoxy)-3-ethyl-7-methylnonaneOxirane, 2-ethyl-3-(3-ethyl-5-(4-ethylphenoxy)pentyl)-2-methyl-RefChem:137313DTXCID5021912260-685-92-ethyl-3-[3-ethyl-5-(4-ethylphenoxy)pentyl]-2-methyloxirane
Show more names
Epofenonateepofenonane,mixtureofdiastereoisomers1-(4-Ethylphenoxy)-3-ethyl-6,7-epoxy-7-methylnonaneOxirane, 2-ethyl-3-[3-ethyl-5-(4-ethylphenoxy)pentyl]-2-methyl-
Epofenonane [ISO]2-Ethyl-3-(3-ethyl-5-(4-ethylphenoxy)pentyl)-2-methyloxiraneUNII-8I82W3V5ZY6,7-EPOXY-3-ETHYL-1-(4-ETHYLPHENOXY)-7-METHYLNONANEEINECS 260-685-9SCHEMBL44253DB-368948NS00001041
Database identifiers
- CAS
57342-02-6- PubChem CID
- 42272
- DTXSID
DTXSID7041912- UNII
- 8I82W3V5ZY
- EC Number
- 260-685-9
- Nikkaji
- J22.304B
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 21.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 309
Physicochemical properties
- Density
- 0.95 g/mL · 0.95 g/mL at 20 °C(lit.)
- storage temp.
- 2 · 2-8°C
- FDA UNII
- 8 I82W3V5ZY · 8I82W3V5ZY
- EPA Substance Registry System
- Epofenonane (57342-02-6)
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
- F
- 10 · 10-21
Safety & regulation
Safety data
- F
- 10-21
- wgk
- 3
- safety_code
- 22-24/25
Chemistry & industry
Suppliers4 total
Carbone Scientific CO., LTD[email protected]
SIGMA—
SIGMAALDRICH—
3B Scientific Corporation[email protected]
Related reactions
1 records
Compound notes
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