(Z)-1-(furan-3-yl)hept-2-en-1-ol

C11H16O2 — CID 135006828

IUPAC(Z)-1-(furan-3-yl)hept-2-en-1-ol
SMILESCCCC/C=C\C(O)c1ccoc1
InChIInChI=1S/C11H16O2/c1-2-3-4-5-6-11(12)10-7-8-13-9-10/h5-9,11-12H,2-4H2,1H3/b6-5-
InChIKeyRGEKXQXGYZHIKS-WAYWQWQTSA-N
MW180.25 g/mol
LogP3.06
Rot. Bonds5

About (Z)-1-(furan-3-yl)hept-2-en-1-ol

(Z)-1-(furan-3-yl)hept-2-en-1-ol (PubChem CID 135006828) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is (Z)-1-(furan-3-yl)hept-2-en-1-ol.

Molecular Properties

Compound Name(Z)-1-(furan-3-yl)hept-2-en-1-ol
PubChem CID135006828
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name(Z)-1-(furan-3-yl)hept-2-en-1-ol
SMILESCCCC/C=C\C(O)c1ccoc1
InChIInChI=1S/C11H16O2/c1-2-3-4-5-6-11(12)10-7-8-13-9-10/h5-9,11-12H,2-4H2,1H3/b6-5-
InChIKeyRGEKXQXGYZHIKS-WAYWQWQTSA-N
XLogP3.06
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(E)-1-phenyloct-2-en-1-ol
CID 10822082
(E,1R)-1-phenylnon-2-en-1-ol
CID 11287425
4-[(E)-1-hydroxyhept-2-enyl]benzonitrile
CID 10921890
1-(furan-3-yl)nonadecan-1-ol
CID 10712867
(E)-1-(4-chlorophenyl)non-2-en-1-ol
CID 11184335
(E,1S)-1-(2-bromophenyl)hept-2-en-1-ol
CID 11245410
(E)-hept-2-ene-1,1-diol
CID 87660901
(E,1S,2R)-1-phenyloct-3-ene-1,2-diol
CID 101054881
(Z,2R)-2-phenyloct-3-en-1-ol
CID 11106477
1-(furan-3-yl)-2,2-dimethylbutan-1-ol
CID 115797313
(E,1R,2S)-2-ethoxy-1-phenyloct-3-en-1-ol
CID 10586659
ethyl 3-(furan-3-yl)-2,3-dihydroxypropanoate
CID 171865500

Frequently Asked Questions

What is the IUPAC name of (Z)-1-(furan-3-yl)hept-2-en-1-ol?
The IUPAC name of (Z)-1-(furan-3-yl)hept-2-en-1-ol (CID 135006828) is (Z)-1-(furan-3-yl)hept-2-en-1-ol.
What is the SMILES notation for (Z)-1-(furan-3-yl)hept-2-en-1-ol?
The canonical SMILES for (Z)-1-(furan-3-yl)hept-2-en-1-ol is CCCC/C=C\C(O)c1ccoc1.
What is the InChIKey of (Z)-1-(furan-3-yl)hept-2-en-1-ol?
The InChIKey is RGEKXQXGYZHIKS-WAYWQWQTSA-N. The full InChI is InChI=1S/C11H16O2/c1-2-3-4-5-6-11(12)10-7-8-13-9-10/h5-9,11-12H,2-4H2,1H3/b6-5-.
What are the key properties of (Z)-1-(furan-3-yl)hept-2-en-1-ol?
(Z)-1-(furan-3-yl)hept-2-en-1-ol has a molecular weight of 180.25 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(furan-3-yl)hept-2-en-1-ol is sourced from PubChem (CID 135006828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).