(E)-4-cyclohexylbut-3-en-2-ol

C10H18O — CID 11084101

IUPAC(E)-4-cyclohexylbut-3-en-2-ol
SMILESCC(O)/C=C/C1CCCCC1
InChIInChI=1S/C10H18O/c1-9(11)7-8-10-5-3-2-4-6-10/h7-11H,2-6H2,1H3/b8-7+
InChIKeyYZVAHJQHXUSGJH-BQYQJAHWSA-N
MW154.25 g/mol
LogP2.50
Rot. Bonds2

About (E)-4-cyclohexylbut-3-en-2-ol

(E)-4-cyclohexylbut-3-en-2-ol (PubChem CID 11084101) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (E)-4-cyclohexylbut-3-en-2-ol.

Molecular Properties

Compound Name(E)-4-cyclohexylbut-3-en-2-ol
PubChem CID11084101
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(E)-4-cyclohexylbut-3-en-2-ol
SMILESCC(O)/C=C/C1CCCCC1
InChIInChI=1S/C10H18O/c1-9(11)7-8-10-5-3-2-4-6-10/h7-11H,2-6H2,1H3/b8-7+
InChIKeyYZVAHJQHXUSGJH-BQYQJAHWSA-N
XLogP2.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-4-cyclohexylbut-3-en-2-ol?
The IUPAC name of (E)-4-cyclohexylbut-3-en-2-ol (CID 11084101) is (E)-4-cyclohexylbut-3-en-2-ol.
What is the SMILES notation for (E)-4-cyclohexylbut-3-en-2-ol?
The canonical SMILES for (E)-4-cyclohexylbut-3-en-2-ol is CC(O)/C=C/C1CCCCC1.
What is the InChIKey of (E)-4-cyclohexylbut-3-en-2-ol?
The InChIKey is YZVAHJQHXUSGJH-BQYQJAHWSA-N. The full InChI is InChI=1S/C10H18O/c1-9(11)7-8-10-5-3-2-4-6-10/h7-11H,2-6H2,1H3/b8-7+.
What are the key properties of (E)-4-cyclohexylbut-3-en-2-ol?
(E)-4-cyclohexylbut-3-en-2-ol has a molecular weight of 154.25 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-cyclohexylbut-3-en-2-ol is sourced from PubChem (CID 11084101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).