ethenoxymethylcyclohexane

C9H16O — CID 15731377

IUPACethenoxymethylcyclohexane
SMILESC=COCC1CCCCC1
InChIInChI=1S/C9H16O/c1-2-10-8-9-6-4-3-5-7-9/h2,9H,1,3-8H2
InChIKeyBIUZXWXXSCLGNK-UHFFFAOYSA-N
MW140.23 g/mol
LogP2.73
Rot. Bonds3

About ethenoxymethylcyclohexane

ethenoxymethylcyclohexane (PubChem CID 15731377) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is ethenoxymethylcyclohexane.

Molecular Properties

Compound Nameethenoxymethylcyclohexane
PubChem CID15731377
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Nameethenoxymethylcyclohexane
SMILESC=COCC1CCCCC1
InChIInChI=1S/C9H16O/c1-2-10-8-9-6-4-3-5-7-9/h2,9H,1,3-8H2
InChIKeyBIUZXWXXSCLGNK-UHFFFAOYSA-N
XLogP2.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Cyclohexane, 1,4-bis[(ethenyloxy)methyl]-
CID 3437285
2-Ethylhexyl vinyl ether
CID 61004
Isooctane, (ethenyloxy)-
CID 296393
Ether, 2,6,8-trimethylnonyl vinyl
CID 25002
Methoxymethylcyclohexane
CID 6432218
Cyclohexyl divinyl ether
CID 57018671
1-(Ethenoxymethyl)-4-(fluoromethoxymethyl)cyclohexane
CID 20593743
[4-(Ethenoxymethyl)cyclohexyl]methyl hypofluorite
CID 20688046
1-(Ethenoxymethyl)-4-(2-fluoroethoxymethyl)cyclohexane
CID 59872809
1-Fluoroethenoxymethylcyclohexane
CID 68559613
4-(Ethenoxymethyl)-1,1-difluorocyclohexane
CID 68560348
2-(4-Ethenoxybutoxymethyl)-1,3,5-trifluorocyclohexane
CID 140421307

Frequently Asked Questions

What is the IUPAC name of ethenoxymethylcyclohexane?
The IUPAC name of ethenoxymethylcyclohexane (CID 15731377) is ethenoxymethylcyclohexane.
What is the SMILES notation for ethenoxymethylcyclohexane?
The canonical SMILES for ethenoxymethylcyclohexane is C=COCC1CCCCC1.
What is the InChIKey of ethenoxymethylcyclohexane?
The InChIKey is BIUZXWXXSCLGNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O/c1-2-10-8-9-6-4-3-5-7-9/h2,9H,1,3-8H2.
What are the key properties of ethenoxymethylcyclohexane?
ethenoxymethylcyclohexane has a molecular weight of 140.23 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethenoxymethylcyclohexane is sourced from PubChem (CID 15731377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).