prop-1-enoxycyclooctane

C11H20O — CID 151595981

IUPACprop-1-enoxycyclooctane
SMILESCC=COC1CCCCCCC1
InChIInChI=1S/C11H20O/c1-2-10-12-11-8-6-4-3-5-7-9-11/h2,10-11H,3-9H2,1H3
InChIKeyQJLZCRGDOZUVAS-UHFFFAOYSA-N
MW168.28 g/mol
LogP3.65
Rot. Bonds2

About prop-1-enoxycyclooctane

prop-1-enoxycyclooctane (PubChem CID 151595981) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is prop-1-enoxycyclooctane.

Molecular Properties

Compound Nameprop-1-enoxycyclooctane
PubChem CID151595981
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Nameprop-1-enoxycyclooctane
SMILESCC=COC1CCCCCCC1
InChIInChI=1S/C11H20O/c1-2-10-12-11-8-6-4-3-5-7-9-11/h2,10-11H,3-9H2,1H3
InChIKeyQJLZCRGDOZUVAS-UHFFFAOYSA-N
XLogP3.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.65
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

1-[(Z)-prop-1-enoxy]decane
CID 11805699
n-Octyl oxypropylene
CID 13709445
3-fluoro-2-[(E)-prop-1-enoxy]decane
CID 18972205
3-Fluoro-2-prop-1-enoxydecane
CID 73473902
Octyl 2-propenyl ether
CID 53810706
1-[(E)-prop-1-enoxy]decane
CID 15357019
2-heptyl-3,4-dihydro-2H-pyran
CID 21596630
Cyclododecane, (1-propenyloxy)-
CID 5374044
1-[(Z)-prop-1-enoxy]dodecane
CID 10900343
Ethenoxycyclooctane
CID 14454749
1-[(E)-prop-1-enoxy]heptane
CID 14637790
1-[(E)-prop-1-enoxy]dodecane
CID 22008108

Frequently Asked Questions

What is the IUPAC name of prop-1-enoxycyclooctane?
The IUPAC name of prop-1-enoxycyclooctane (CID 151595981) is prop-1-enoxycyclooctane.
What is the SMILES notation for prop-1-enoxycyclooctane?
The canonical SMILES for prop-1-enoxycyclooctane is CC=COC1CCCCCCC1.
What is the InChIKey of prop-1-enoxycyclooctane?
The InChIKey is QJLZCRGDOZUVAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-2-10-12-11-8-6-4-3-5-7-9-11/h2,10-11H,3-9H2,1H3.
What are the key properties of prop-1-enoxycyclooctane?
prop-1-enoxycyclooctane has a molecular weight of 168.28 g/mol, XLogP of 3.65, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for prop-1-enoxycyclooctane is sourced from PubChem (CID 151595981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).