1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol

C15H24O2 — CID 134836660

IUPAC1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol
SMILESC=CCOC/C(=C\C)C1CCCCC1(O)C=C
InChIInChI=1S/C15H24O2/c1-4-11-17-12-13(5-2)14-9-7-8-10-15(14,16)6-3/h4-6,14,16H,1,3,7-12H2,2H3/b13-5+
InChIKeyUTOFHBZMGZPMOS-WLRTZDKTSA-N
MW236.35 g/mol
LogP3.24
Rot. Bonds6

About 1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol

1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol (PubChem CID 134836660) has the molecular formula C15H24O2 and a molecular weight of 236.35 g/mol. Its IUPAC name is 1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol
PubChem CID134836660
Molecular FormulaC15H24O2
Molecular Weight236.35 g/mol
Exact Mass236.18
IUPAC Name1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol
SMILESC=CCOC/C(=C\C)C1CCCCC1(O)C=C
InChIInChI=1S/C15H24O2/c1-4-11-17-12-13(5-2)14-9-7-8-10-15(14,16)6-3/h4-6,14,16H,1,3,7-12H2,2H3/b13-5+
InChIKeyUTOFHBZMGZPMOS-WLRTZDKTSA-N
XLogP3.24
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.35
LogP ≤ 53.24
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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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol?
The IUPAC name of 1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol (CID 134836660) is 1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol?
The canonical SMILES for 1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol is C=CCOC/C(=C\C)C1CCCCC1(O)C=C.
What is the InChIKey of 1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol?
The InChIKey is UTOFHBZMGZPMOS-WLRTZDKTSA-N. The full InChI is InChI=1S/C15H24O2/c1-4-11-17-12-13(5-2)14-9-7-8-10-15(14,16)6-3/h4-6,14,16H,1,3,7-12H2,2H3/b13-5+.
What are the key properties of 1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol?
1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol has a molecular weight of 236.35 g/mol, XLogP of 3.24, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2-[(Z)-1-prop-2-enoxybut-2-en-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 134836660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).