(1R)-1-(2-ethoxy-5-methylphenyl)ethanol

C11H16O2 — CID 63364902

IUPAC(1R)-1-(2-ethoxy-5-methylphenyl)ethanol
SMILESCCOc1ccc(C)cc1[C@@H](C)O
InChIInChI=1S/C11H16O2/c1-4-13-11-6-5-8(2)7-10(11)9(3)12/h5-7,9,12H,4H2,1-3H3/t9-/m1/s1
InChIKeySDRGOXVJQQHRDB-SECBINFHSA-N
MW180.25 g/mol
LogP2.45
Rot. Bonds3

About (1R)-1-(2-ethoxy-5-methylphenyl)ethanol

(1R)-1-(2-ethoxy-5-methylphenyl)ethanol (PubChem CID 63364902) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is (1R)-1-(2-ethoxy-5-methylphenyl)ethanol.

Molecular Properties

Compound Name(1R)-1-(2-ethoxy-5-methylphenyl)ethanol
PubChem CID63364902
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name(1R)-1-(2-ethoxy-5-methylphenyl)ethanol
SMILESCCOc1ccc(C)cc1[C@@H](C)O
InChIInChI=1S/C11H16O2/c1-4-13-11-6-5-8(2)7-10(11)9(3)12/h5-7,9,12H,4H2,1-3H3/t9-/m1/s1
InChIKeySDRGOXVJQQHRDB-SECBINFHSA-N
XLogP2.45
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(2-ethoxyethoxy)-5-methylphenyl]ethanol
CID 43505298
1-[2-(2,2-difluoroethoxy)-5-methylphenyl]ethanol
CID 60923086
3-[2-[(1R)-1-hydroxyethyl]-4-methylphenoxy]propane-1,2-diol
CID 82849372
1-[2-(3-methoxypropoxy)-5-methylphenyl]ethanol
CID 60925219
(1S)-1-(2-but-2-enoxy-5-methylphenyl)ethanol
CID 78934280
1-[2-[(2,5-dimethylphenyl)methoxy]-5-methylphenyl]ethanol
CID 61481674
(1R)-1-(2-but-2-enoxy-5-methylphenyl)ethanol
CID 78931205
1-[2-[(1R)-1-hydroxyethyl]-4-methylphenoxy]-3-methoxypropan-2-ol
CID 63928842
1-(2-but-2-ynoxy-5-methylphenyl)ethanol
CID 62311951
1-[2-(2-chloroprop-2-enoxy)-5-methylphenyl]ethanol
CID 43505392
3-[2-[(1R)-1-hydroxyethyl]-4-methylphenoxy]-N,N-dimethylpropanamide
CID 63366501
1-[2-(3-ethylsulfanylpropoxy)-5-methylphenyl]ethanol
CID 113473755

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2-ethoxy-5-methylphenyl)ethanol?
The IUPAC name of (1R)-1-(2-ethoxy-5-methylphenyl)ethanol (CID 63364902) is (1R)-1-(2-ethoxy-5-methylphenyl)ethanol.
What is the SMILES notation for (1R)-1-(2-ethoxy-5-methylphenyl)ethanol?
The canonical SMILES for (1R)-1-(2-ethoxy-5-methylphenyl)ethanol is CCOc1ccc(C)cc1[C@@H](C)O.
What is the InChIKey of (1R)-1-(2-ethoxy-5-methylphenyl)ethanol?
The InChIKey is SDRGOXVJQQHRDB-SECBINFHSA-N. The full InChI is InChI=1S/C11H16O2/c1-4-13-11-6-5-8(2)7-10(11)9(3)12/h5-7,9,12H,4H2,1-3H3/t9-/m1/s1.
What are the key properties of (1R)-1-(2-ethoxy-5-methylphenyl)ethanol?
(1R)-1-(2-ethoxy-5-methylphenyl)ethanol has a molecular weight of 180.25 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2-ethoxy-5-methylphenyl)ethanol is sourced from PubChem (CID 63364902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).