1,1-bis(prop-1-enoxymethyl)cyclohexane

C14H24O2 — CID 67047560

IUPAC1,1-bis(prop-1-enoxymethyl)cyclohexane
SMILESCC=COCC1(COC=CC)CCCCC1
InChIInChI=1S/C14H24O2/c1-3-10-15-12-14(13-16-11-4-2)8-6-5-7-9-14/h3-4,10-11H,5-9,12-13H2,1-2H3
InChIKeyYEWJMVMZOGOHJI-UHFFFAOYSA-N
MW224.34 g/mol
LogP4.04
Rot. Bonds6

About 1,1-bis(prop-1-enoxymethyl)cyclohexane

1,1-bis(prop-1-enoxymethyl)cyclohexane (PubChem CID 67047560) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 1,1-bis(prop-1-enoxymethyl)cyclohexane.

Molecular Properties

Compound Name1,1-bis(prop-1-enoxymethyl)cyclohexane
PubChem CID67047560
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name1,1-bis(prop-1-enoxymethyl)cyclohexane
SMILESCC=COCC1(COC=CC)CCCCC1
InChIInChI=1S/C14H24O2/c1-3-10-15-12-14(13-16-11-4-2)8-6-5-7-9-14/h3-4,10-11H,5-9,12-13H2,1-2H3
InChIKeyYEWJMVMZOGOHJI-UHFFFAOYSA-N
XLogP4.04
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1-bis(prop-1-enoxymethyl)cyclohexane?
The IUPAC name of 1,1-bis(prop-1-enoxymethyl)cyclohexane (CID 67047560) is 1,1-bis(prop-1-enoxymethyl)cyclohexane.
What is the SMILES notation for 1,1-bis(prop-1-enoxymethyl)cyclohexane?
The canonical SMILES for 1,1-bis(prop-1-enoxymethyl)cyclohexane is CC=COCC1(COC=CC)CCCCC1.
What is the InChIKey of 1,1-bis(prop-1-enoxymethyl)cyclohexane?
The InChIKey is YEWJMVMZOGOHJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-3-10-15-12-14(13-16-11-4-2)8-6-5-7-9-14/h3-4,10-11H,5-9,12-13H2,1-2H3.
What are the key properties of 1,1-bis(prop-1-enoxymethyl)cyclohexane?
1,1-bis(prop-1-enoxymethyl)cyclohexane has a molecular weight of 224.34 g/mol, XLogP of 4.04, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(prop-1-enoxymethyl)cyclohexane is sourced from PubChem (CID 67047560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).