cyclohexanol;prop-1-ene

C9H18O — CID 174901764

IUPACcyclohexanol;prop-1-ene
SMILESC=CC.OC1CCCCC1
InChIInChI=1S/C6H12O.C3H6/c7-6-4-2-1-3-5-6;1-3-2/h6-7H,1-5H2;3H,1H2,2H3
InChIKeyFUUFFMQLFPLWJF-UHFFFAOYSA-N
MW142.24 g/mol
LogP2.50
Rot. Bonds

About cyclohexanol;prop-1-ene

cyclohexanol;prop-1-ene (PubChem CID 174901764) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is cyclohexanol;prop-1-ene.

Molecular Properties

Compound Namecyclohexanol;prop-1-ene
PubChem CID174901764
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Namecyclohexanol;prop-1-ene
SMILESC=CC.OC1CCCCC1
InChIInChI=1S/C6H12O.C3H6/c7-6-4-2-1-3-5-6;1-3-2/h6-7H,1-5H2;3H,1H2,2H3
InChIKeyFUUFFMQLFPLWJF-UHFFFAOYSA-N
XLogP2.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
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 cyclohexanol;prop-1-ene?
The IUPAC name of cyclohexanol;prop-1-ene (CID 174901764) is cyclohexanol;prop-1-ene.
What is the SMILES notation for cyclohexanol;prop-1-ene?
The canonical SMILES for cyclohexanol;prop-1-ene is C=CC.OC1CCCCC1.
What is the InChIKey of cyclohexanol;prop-1-ene?
The InChIKey is FUUFFMQLFPLWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O.C3H6/c7-6-4-2-1-3-5-6;1-3-2/h6-7H,1-5H2;3H,1H2,2H3.
What are the key properties of cyclohexanol;prop-1-ene?
cyclohexanol;prop-1-ene has a molecular weight of 142.24 g/mol, XLogP of 2.50, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexanol;prop-1-ene is sourced from PubChem (CID 174901764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).