Basic information
- CAS
4799-66-0- Standard SMILES
CC(OCCO)c1ccccc1- InChIKey
BMHHGQVJEGDNJM-UHFFFAOYSA-N- Molecular formula
- C10H14O2
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.09937969
Names & identifiers
- Preferred name
- Ethanol, 2-(1-phenylethoxy)-
- IUPAC
- 2-(1-phenylethoxy)ethanol
- English name
- ETHANOL,2-(ALPHA-METHYLBENZYLOXY)-
- Molecular formula
- C10H14O2
- Molecular weight
- 166.22
Names & synonyms
2-(1-Phenylethoxy)ethanol4-Phenyl-3-oxapentanol-1Ethanol, 2-(1-phenylethoxy)-4799-66-0Ethanol, 2-[(.alpha.-methylbenzyl)oxy]-.alpha.-methylbenzyloxy ethanolalpha-Methylbenzyloxy ethanol2-(1-phenylethoxy)ethan-1-olNSC 26601BRN 1866452ETHANOL, 2-(alpha-METHYLBENZYLOXY)-Ethanol,2-(1-phenylethoxy)-
Show more names
4-PHENYL-3-OXAPENTANOL2-(α-Methylbenzyloxy)ethanolETHANOL,2-(ALPHA-METHYLBENZYLOXY)-
AI3-00164SCHEMBL97126SCHEMBL97127WLN: Q2OY1&R2-(1-Phenylethoxy)ethanol #SCHEMBL17844755BMHHGQVJEGDNJM-UHFFFAOYSA-NDTXSID801312393
Database identifiers
- CAS
4799-66-0- PubChem CID
- 20932
- DTXSID
DTXSID801312393- Nikkaji
- J49.841F
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 108
Physicochemical properties
- Boiling point
- 122 °C · 122 °C(Press: 10 Torr)
- Density
- 1.0405 g/cm3 · 1.0405 g/cm3
- pka
- 14.34 · 14.34±0.10(Predicted)
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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