ethanol;1-(2-ethylphenyl)ethanol

C12H20O2 — CID 174807968

IUPACethanol;1-(2-ethylphenyl)ethanol
SMILESCCO.CCc1ccccc1C(C)O
InChIInChI=1S/C10H14O.C2H6O/c1-3-9-6-4-5-7-10(9)8(2)11;1-2-3/h4-8,11H,3H2,1-2H3;3H,2H2,1H3
InChIKeyRUASTAOZDJJCAZ-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.30
Rot. Bonds2

About ethanol;1-(2-ethylphenyl)ethanol

ethanol;1-(2-ethylphenyl)ethanol (PubChem CID 174807968) has the molecular formula C12H20O2 and a molecular weight of 196.29 g/mol. Its IUPAC name is ethanol;1-(2-ethylphenyl)ethanol.

Molecular Properties

Compound Nameethanol;1-(2-ethylphenyl)ethanol
PubChem CID174807968
Molecular FormulaC12H20O2
Molecular Weight196.29 g/mol
Exact Mass196.15
IUPAC Nameethanol;1-(2-ethylphenyl)ethanol
SMILESCCO.CCc1ccccc1C(C)O
InChIInChI=1S/C10H14O.C2H6O/c1-3-9-6-4-5-7-10(9)8(2)11;1-2-3/h4-8,11H,3H2,1-2H3;3H,2H2,1H3
InChIKeyRUASTAOZDJJCAZ-UHFFFAOYSA-N
XLogP2.30
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-ethylphenyl)-3-methylbutan-1-ol
CID 63901974
1-(3-ethyl-2-methoxyphenyl)ethanol
CID 84657475
1-(2-prop-2-enylphenyl)ethanol
CID 10749513
(2-ethoxyphenyl)-(2-ethylphenyl)methanol
CID 63900742
3-(2-ethylphenyl)-3-hydroxy-2-methylpropanenitrile
CID 79132676
1-ethyl-2-[(2S)-pentan-2-yl]benzene
CID 144927407
1-(2-ethylphenyl)-2-methylpropan-1-amine
CID 55283279
1-[2-[2-(2-hydroxyethoxy)ethyl]phenyl]ethanol
CID 175511587
4-(2-ethylphenyl)-4-hydroxy-3-methylbutanoic acid
CID 62390532
2-(2-ethylphenyl)-2-(methylamino)ethanol
CID 62415682
(2-bromophenyl)-(2-ethylphenyl)methanol
CID 91657587
(2S)-2-(2-ethylphenyl)-2-(methylamino)ethanol
CID 55276460

Frequently Asked Questions

What is the IUPAC name of ethanol;1-(2-ethylphenyl)ethanol?
The IUPAC name of ethanol;1-(2-ethylphenyl)ethanol (CID 174807968) is ethanol;1-(2-ethylphenyl)ethanol.
What is the SMILES notation for ethanol;1-(2-ethylphenyl)ethanol?
The canonical SMILES for ethanol;1-(2-ethylphenyl)ethanol is CCO.CCc1ccccc1C(C)O.
What is the InChIKey of ethanol;1-(2-ethylphenyl)ethanol?
The InChIKey is RUASTAOZDJJCAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O.C2H6O/c1-3-9-6-4-5-7-10(9)8(2)11;1-2-3/h4-8,11H,3H2,1-2H3;3H,2H2,1H3.
What are the key properties of ethanol;1-(2-ethylphenyl)ethanol?
ethanol;1-(2-ethylphenyl)ethanol has a molecular weight of 196.29 g/mol, XLogP of 2.30, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;1-(2-ethylphenyl)ethanol is sourced from PubChem (CID 174807968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).