cyclohexa-2,4-dien-1-yloxycyclooctane

C14H22O — CID 123602198

IUPACcyclohexa-2,4-dien-1-yloxycyclooctane
SMILESC1=CCC(OC2CCCCCCC2)C=C1
InChIInChI=1S/C14H22O/c1-2-5-9-13(10-6-3-1)15-14-11-7-4-8-12-14/h4,7-8,11,13-14H,1-3,5-6,9-10,12H2
InChIKeyWXRZWRYBOXGKGR-UHFFFAOYSA-N
MW206.33 g/mol
LogP4.00
Rot. Bonds2

About cyclohexa-2,4-dien-1-yloxycyclooctane

cyclohexa-2,4-dien-1-yloxycyclooctane (PubChem CID 123602198) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is cyclohexa-2,4-dien-1-yloxycyclooctane.

Molecular Properties

Compound Namecyclohexa-2,4-dien-1-yloxycyclooctane
PubChem CID123602198
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Namecyclohexa-2,4-dien-1-yloxycyclooctane
SMILESC1=CCC(OC2CCCCCCC2)C=C1
InChIInChI=1S/C14H22O/c1-2-5-9-13(10-6-3-1)15-14-11-7-4-8-12-14/h4,7-8,11,13-14H,1-3,5-6,9-10,12H2
InChIKeyWXRZWRYBOXGKGR-UHFFFAOYSA-N
XLogP4.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-(4-propan-2-ylcyclohex-3-en-1-yl)oxycyclohexa-1,3-diene
CID 123617028
cyclohexene;cyclohexyloxycyclohexane
CID 174935806
7-methoxycycloocta-1,3,5-triene
CID 71368516
1,4-bis[(4-cyclohexyloxycyclohexyl)oxy]cyclohexane
CID 140552812
cyclobutyloxycyclohexane
CID 89332762
di(cyclohexa-2,4-dien-1-yloxy)methanimine
CID 163641188
CID 173424592
CID 173424592
(1Z,3Z)-5,11-dimethylcyclododeca-1,3-diene
CID 144931103
cyclohexa-2,4-dien-1-yl(cyclohexyl)diazene
CID 5232523
cyclohexa-2,4-dien-1-yl 2,5-dicyclohexylbenzenesulfonate
CID 144724995
cyclohexa-2,4-dien-1-yl propanoate
CID 19827271
5-(5-cyclopentylpentyl)cyclohexa-1,3-diene
CID 142426678

Frequently Asked Questions

What is the IUPAC name of cyclohexa-2,4-dien-1-yloxycyclooctane?
The IUPAC name of cyclohexa-2,4-dien-1-yloxycyclooctane (CID 123602198) is cyclohexa-2,4-dien-1-yloxycyclooctane.
What is the SMILES notation for cyclohexa-2,4-dien-1-yloxycyclooctane?
The canonical SMILES for cyclohexa-2,4-dien-1-yloxycyclooctane is C1=CCC(OC2CCCCCCC2)C=C1.
What is the InChIKey of cyclohexa-2,4-dien-1-yloxycyclooctane?
The InChIKey is WXRZWRYBOXGKGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O/c1-2-5-9-13(10-6-3-1)15-14-11-7-4-8-12-14/h4,7-8,11,13-14H,1-3,5-6,9-10,12H2.
What are the key properties of cyclohexa-2,4-dien-1-yloxycyclooctane?
cyclohexa-2,4-dien-1-yloxycyclooctane has a molecular weight of 206.33 g/mol, XLogP of 4.00, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexa-2,4-dien-1-yloxycyclooctane is sourced from PubChem (CID 123602198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).