Basic information
- CAS
29643-63-8- Standard SMILES
CCCOc1ccccc1CC- InChIKey
YXAVHGJCPBCXJZ-UHFFFAOYSA-N- Molecular formula
- C11H16O
- Average molar mass
- 164.24 g/mol
- Monoisotopic mass
- 164.12011513
Names & identifiers
- Preferred name
- 1-Ethyl-2-propoxybenzene
- IUPAC
- 1-ethyl-2-propoxybenzene
- English name
- 2-Ethoxypropylbenzene
- Molecular formula
- C11H16O
- Molecular weight
- 164.24
Names & synonyms
o-Ethylphenyl propyl ether29643-63-8Ether, o-ethylphenyl propyl1-ethyl-2-propoxybenzene2-ETHOXYPROPYLBENZENE2-Ethylphenol, n-propyl etherSCHEMBL3200496SCHEMBL3200502SCHEMBL5420692SCHEMBL6473919SCHEMBL16961397SCHEMBL21268377
Show more names
Benzene, 1-ethyl-2-propoxy-
DTXSID00952111AKOS008948245
Database identifiers
- CAS
29643-63-8- PubChem CID
- 3015477
- DTXSID
DTXSID00952111- Nikkaji
- J155.039J
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 112
Physicochemical properties
- Boiling point
- 220.774 · 220.774±9.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.916 · 0.916±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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