1-propa-1,2-dienylcyclooctene

C11H16 — CID 174562803

IUPAC1-propa-1,2-dienylcyclooctene
SMILESC=C=CC1=CCCCCCC1
InChIInChI=1S/C11H16/c1-2-8-11-9-6-4-3-5-7-10-11/h8-9H,1,3-7,10H2
InChIKeyBQWRSQSJKOJFPR-UHFFFAOYSA-N
MW148.25 g/mol
LogP3.61
Rot. Bonds1

About 1-propa-1,2-dienylcyclooctene

1-propa-1,2-dienylcyclooctene (PubChem CID 174562803) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is 1-propa-1,2-dienylcyclooctene.

Molecular Properties

Compound Name1-propa-1,2-dienylcyclooctene
PubChem CID174562803
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name1-propa-1,2-dienylcyclooctene
SMILESC=C=CC1=CCCCCCC1
InChIInChI=1S/C11H16/c1-2-8-11-9-6-4-3-5-7-10-11/h8-9H,1,3-7,10H2
InChIKeyBQWRSQSJKOJFPR-UHFFFAOYSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethenylcyclooctene
CID 54012738
(1E)-cyclononene-1-carbaldehyde
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1-[(Z)-prop-1-enyl]cycloheptene
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1-ethenylcyclohexene;methylidenecyclopropane
CID 159160472
(1Z,3E,5E)-cyclododeca-1,3,5-triene;1-ethenylcyclohexene
CID 141453701
1-[3-[3-(cyclohexen-1-yl)prop-2-ynylsulfonyl]propa-1,2-dienyl]cyclohexene
CID 11630844
3-[(1E)-cycloocten-1-yl]prop-2-enoic acid
CID 70063613
(1E)-N-ethenylcycloocten-1-amine
CID 67050808
cyclohexadecen-1-amine
CID 175415425
(1E)-cyclotridecen-1-amine
CID 141088485
2-(cyclohexen-1-yl)-N,N-dimethylethenamine
CID 71333973
1-(cyclodecen-1-yl)cyclodecene
CID 54296371

Frequently Asked Questions

What is the IUPAC name of 1-propa-1,2-dienylcyclooctene?
The IUPAC name of 1-propa-1,2-dienylcyclooctene (CID 174562803) is 1-propa-1,2-dienylcyclooctene.
What is the SMILES notation for 1-propa-1,2-dienylcyclooctene?
The canonical SMILES for 1-propa-1,2-dienylcyclooctene is C=C=CC1=CCCCCCC1.
What is the InChIKey of 1-propa-1,2-dienylcyclooctene?
The InChIKey is BQWRSQSJKOJFPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16/c1-2-8-11-9-6-4-3-5-7-10-11/h8-9H,1,3-7,10H2.
What are the key properties of 1-propa-1,2-dienylcyclooctene?
1-propa-1,2-dienylcyclooctene has a molecular weight of 148.25 g/mol, XLogP of 3.61, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propa-1,2-dienylcyclooctene is sourced from PubChem (CID 174562803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).