3-(furan-3-yl)cyclohept-2-en-1-ol

C11H14O2 — CID 107383481

IUPAC3-(furan-3-yl)cyclohept-2-en-1-ol
SMILESOC1C=C(c2ccoc2)CCCC1
InChIInChI=1S/C11H14O2/c12-11-4-2-1-3-9(7-11)10-5-6-13-8-10/h5-8,11-12H,1-4H2
InChIKeyVPFSCTPQSFGGOB-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.60
Rot. Bonds1

About 3-(furan-3-yl)cyclohept-2-en-1-ol

3-(furan-3-yl)cyclohept-2-en-1-ol (PubChem CID 107383481) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 3-(furan-3-yl)cyclohept-2-en-1-ol.

Molecular Properties

Compound Name3-(furan-3-yl)cyclohept-2-en-1-ol
PubChem CID107383481
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name3-(furan-3-yl)cyclohept-2-en-1-ol
SMILESOC1C=C(c2ccoc2)CCCC1
InChIInChI=1S/C11H14O2/c12-11-4-2-1-3-9(7-11)10-5-6-13-8-10/h5-8,11-12H,1-4H2
InChIKeyVPFSCTPQSFGGOB-UHFFFAOYSA-N
XLogP2.60
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-3-yl)cyclohept-2-en-1-ol?
The IUPAC name of 3-(furan-3-yl)cyclohept-2-en-1-ol (CID 107383481) is 3-(furan-3-yl)cyclohept-2-en-1-ol.
What is the SMILES notation for 3-(furan-3-yl)cyclohept-2-en-1-ol?
The canonical SMILES for 3-(furan-3-yl)cyclohept-2-en-1-ol is OC1C=C(c2ccoc2)CCCC1.
What is the InChIKey of 3-(furan-3-yl)cyclohept-2-en-1-ol?
The InChIKey is VPFSCTPQSFGGOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c12-11-4-2-1-3-9(7-11)10-5-6-13-8-10/h5-8,11-12H,1-4H2.
What are the key properties of 3-(furan-3-yl)cyclohept-2-en-1-ol?
3-(furan-3-yl)cyclohept-2-en-1-ol has a molecular weight of 178.23 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-3-yl)cyclohept-2-en-1-ol is sourced from PubChem (CID 107383481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).