(5-ethyl-2,3-dihydrofuran-3-yl)methanol

C7H12O2 — CID 142878345

IUPAC(5-ethyl-2,3-dihydrofuran-3-yl)methanol
SMILESCCC1=CC(CO)CO1
InChIInChI=1S/C7H12O2/c1-2-7-3-6(4-8)5-9-7/h3,6,8H,2,4-5H2,1H3
InChIKeyYWLWVZVTQZUNNJ-UHFFFAOYSA-N
MW128.17 g/mol
LogP0.92
Rot. Bonds2

About (5-ethyl-2,3-dihydrofuran-3-yl)methanol

(5-ethyl-2,3-dihydrofuran-3-yl)methanol (PubChem CID 142878345) has the molecular formula C7H12O2 and a molecular weight of 128.17 g/mol. Its IUPAC name is (5-ethyl-2,3-dihydrofuran-3-yl)methanol.

Molecular Properties

Compound Name(5-ethyl-2,3-dihydrofuran-3-yl)methanol
PubChem CID142878345
Molecular FormulaC7H12O2
Molecular Weight128.17 g/mol
Exact Mass128.08
IUPAC Name(5-ethyl-2,3-dihydrofuran-3-yl)methanol
SMILESCCC1=CC(CO)CO1
InChIInChI=1S/C7H12O2/c1-2-7-3-6(4-8)5-9-7/h3,6,8H,2,4-5H2,1H3
InChIKeyYWLWVZVTQZUNNJ-UHFFFAOYSA-N
XLogP0.92
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-ethyl-5-methyl-2,3-dihydrofuran
CID 163483277
[(1R)-4-ethyl-3-fluorocyclohexa-2,4-dien-1-yl]methanol
CID 89419033
(3-ethylcyclopenten-1-yl)methanol
CID 22134204
oxiran-2-ylmethanol;propane
CID 91466926
(2R,3S,4S)-2-ethyl-2-(hydroxymethyl)oxolane-3,4-diol
CID 158000416
(3aS,7aR)-6-ethyl-3,3a,4,7a-tetrahydro-1H-2-benzofuran-5-one
CID 101347440
[2-(ethoxymethyl)-2,3,7,8-tetrahydro-1,4-benzodioxin-7-yl]methanol
CID 142169778
(2R)-4-ethyl-2-hydroxy-2H-furan-5-one
CID 124583750
(3-bromo-5-methylcyclohexa-2,4-dien-1-yl)methanol
CID 167167725
methyl 3-(aminomethyl)-2,3-dihydrofuran-5-carboxylate
CID 130980013
[(1R)-3-methoxycyclohex-2-en-1-yl]methanol
CID 86333342
(4-ethyl-2,6-dimethylcyclohex-3-en-1-yl)methanol
CID 89004722

Frequently Asked Questions

What is the IUPAC name of (5-ethyl-2,3-dihydrofuran-3-yl)methanol?
The IUPAC name of (5-ethyl-2,3-dihydrofuran-3-yl)methanol (CID 142878345) is (5-ethyl-2,3-dihydrofuran-3-yl)methanol.
What is the SMILES notation for (5-ethyl-2,3-dihydrofuran-3-yl)methanol?
The canonical SMILES for (5-ethyl-2,3-dihydrofuran-3-yl)methanol is CCC1=CC(CO)CO1.
What is the InChIKey of (5-ethyl-2,3-dihydrofuran-3-yl)methanol?
The InChIKey is YWLWVZVTQZUNNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O2/c1-2-7-3-6(4-8)5-9-7/h3,6,8H,2,4-5H2,1H3.
What are the key properties of (5-ethyl-2,3-dihydrofuran-3-yl)methanol?
(5-ethyl-2,3-dihydrofuran-3-yl)methanol has a molecular weight of 128.17 g/mol, XLogP of 0.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethyl-2,3-dihydrofuran-3-yl)methanol is sourced from PubChem (CID 142878345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).