3-[2-(furan-2-yl)-2-hydroxyethyl]phenol

C12H12O3 — CID 71201493

IUPAC3-[2-(furan-2-yl)-2-hydroxyethyl]phenol
SMILESOc1cccc(CC(O)c2ccco2)c1
InChIInChI=1S/C12H12O3/c13-10-4-1-3-9(7-10)8-11(14)12-5-2-6-15-12/h1-7,11,13-14H,8H2
InChIKeyQAWVFHJHNMXAER-UHFFFAOYSA-N
MW204.22 g/mol
LogP2.26
Rot. Bonds3

About 3-[2-(furan-2-yl)-2-hydroxyethyl]phenol

3-[2-(furan-2-yl)-2-hydroxyethyl]phenol (PubChem CID 71201493) has the molecular formula C12H12O3 and a molecular weight of 204.22 g/mol. Its IUPAC name is 3-[2-(furan-2-yl)-2-hydroxyethyl]phenol.

Molecular Properties

Compound Name3-[2-(furan-2-yl)-2-hydroxyethyl]phenol
PubChem CID71201493
Molecular FormulaC12H12O3
Molecular Weight204.22 g/mol
Exact Mass204.08
IUPAC Name3-[2-(furan-2-yl)-2-hydroxyethyl]phenol
SMILESOc1cccc(CC(O)c2ccco2)c1
InChIInChI=1S/C12H12O3/c13-10-4-1-3-9(7-10)8-11(14)12-5-2-6-15-12/h1-7,11,13-14H,8H2
InChIKeyQAWVFHJHNMXAER-UHFFFAOYSA-N
XLogP2.26
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.22
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(furan-2-yl)-2-naphthalen-2-ylethanol
CID 55150829
3-[2-(4-aminophenyl)-2-hydroxyethyl]phenol;hydrochloride
CID 70614947
3-(2-sulfanylpropyl)phenol
CID 115013475
5-(3-hydroxyphenyl)pentane-1,3,4-triol
CID 175541454
(1S)-1-(furan-2-yl)-2-(6-methyl-2-pyridinyl)ethanol
CID 125478801
3-(2-fluoro-3-hydroxypropyl)phenol
CID 105434418
3-(3-hydroxy-2-methylpentyl)phenol
CID 19426978
3-[2-(3-ethyl-2-pyridinyl)-2-hydroxyethyl]phenol
CID 82730497
(1R)-3-chloro-1-(furan-2-yl)propan-1-ol
CID 67216727
3-chloro-1-(furan-2-yl)propan-1-ol
CID 77242319
acetylene;(1S)-1-(furan-2-yl)propan-1-ol
CID 143788269
(1S,3S)-1-(furan-2-yl)butane-1,3-diol
CID 46177371

Frequently Asked Questions

What is the IUPAC name of 3-[2-(furan-2-yl)-2-hydroxyethyl]phenol?
The IUPAC name of 3-[2-(furan-2-yl)-2-hydroxyethyl]phenol (CID 71201493) is 3-[2-(furan-2-yl)-2-hydroxyethyl]phenol.
What is the SMILES notation for 3-[2-(furan-2-yl)-2-hydroxyethyl]phenol?
The canonical SMILES for 3-[2-(furan-2-yl)-2-hydroxyethyl]phenol is Oc1cccc(CC(O)c2ccco2)c1.
What is the InChIKey of 3-[2-(furan-2-yl)-2-hydroxyethyl]phenol?
The InChIKey is QAWVFHJHNMXAER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O3/c13-10-4-1-3-9(7-10)8-11(14)12-5-2-6-15-12/h1-7,11,13-14H,8H2.
What are the key properties of 3-[2-(furan-2-yl)-2-hydroxyethyl]phenol?
3-[2-(furan-2-yl)-2-hydroxyethyl]phenol has a molecular weight of 204.22 g/mol, XLogP of 2.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(furan-2-yl)-2-hydroxyethyl]phenol is sourced from PubChem (CID 71201493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).