(1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol

C10H14O3 — CID 78931625

IUPAC(1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol
SMILESC[C@H](O)c1ccccc1OCCO
InChIInChI=1S/C10H14O3/c1-8(12)9-4-2-3-5-10(9)13-7-6-11/h2-5,8,11-12H,6-7H2,1H3/t8-/m0/s1
InChIKeyVYNIRAMXAIBNNU-QMMMGPOBSA-N
MW182.22 g/mol
LogP1.11
Rot. Bonds4

About (1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol

(1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol (PubChem CID 78931625) has the molecular formula C10H14O3 and a molecular weight of 182.22 g/mol. Its IUPAC name is (1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol
PubChem CID78931625
Molecular FormulaC10H14O3
Molecular Weight182.22 g/mol
Exact Mass182.09
IUPAC Name(1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol
SMILESC[C@H](O)c1ccccc1OCCO
InChIInChI=1S/C10H14O3/c1-8(12)9-4-2-3-5-10(9)13-7-6-11/h2-5,8,11-12H,6-7H2,1H3/t8-/m0/s1
InChIKeyVYNIRAMXAIBNNU-QMMMGPOBSA-N
XLogP1.11
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-[2-[2-(2-hydroxyethoxy)ethoxy]phenyl]ethanol
CID 78931201
5-[2-[(1R)-1-hydroxyethyl]phenoxy]pentan-1-ol
CID 63364920
1-(2-propoxyphenyl)ethanol
CID 43503976
1-[2-(2-phenoxyethoxy)phenyl]ethanol
CID 54794905
(1R)-1-[2-(3-fluoropropoxy)phenyl]ethanol
CID 81114221
1-[2-(4-methylpentoxy)phenyl]ethanol
CID 112684876
(1S)-1-(2-octoxyphenyl)ethanol
CID 55223229
(1R)-1-(2-nonoxyphenyl)ethanol
CID 78944592
(1S)-1-[2-[2-(2-methylpropoxy)ethoxy]phenyl]ethanol
CID 106453765
(1S)-1-[2-(2-phenylethoxy)phenyl]ethanol
CID 78931363
1,5-dihydroxy-1,5-bis[2-(2-hydroxyethoxy)phenyl]-2,4-dimethylpentan-3-one
CID 175584858
4-[2-[(1R)-1-hydroxyethyl]phenoxy]-2-methylbutan-2-ol
CID 79355173

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol?
The IUPAC name of (1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol (CID 78931625) is (1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol.
What is the SMILES notation for (1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol?
The canonical SMILES for (1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol is C[C@H](O)c1ccccc1OCCO.
What is the InChIKey of (1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol?
The InChIKey is VYNIRAMXAIBNNU-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H14O3/c1-8(12)9-4-2-3-5-10(9)13-7-6-11/h2-5,8,11-12H,6-7H2,1H3/t8-/m0/s1.
What are the key properties of (1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol?
(1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol has a molecular weight of 182.22 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol is sourced from PubChem (CID 78931625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).