(1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene

C13H18 — CID 144855425

IUPAC(1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene
SMILESCC/C1=C/C=C\C/C=C\C(C)=C/C1
InChIInChI=1S/C13H18/c1-3-13-9-7-5-4-6-8-12(2)10-11-13/h5-10H,3-4,11H2,1-2H3/b7-5-,8-6-,12-10-,13-9-
InChIKeyJQNJUULYZLQGSW-DOBIPFTLSA-N
MW174.29 g/mol
LogP4.18
Rot. Bonds1

About (1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene

(1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene (PubChem CID 144855425) has the molecular formula C13H18 and a molecular weight of 174.29 g/mol. Its IUPAC name is (1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene.

Molecular Properties

Compound Name(1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene
PubChem CID144855425
Molecular FormulaC13H18
Molecular Weight174.29 g/mol
Exact Mass174.14
IUPAC Name(1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene
SMILESCC/C1=C/C=C\C/C=C\C(C)=C/C1
InChIInChI=1S/C13H18/c1-3-13-9-7-5-4-6-8-12(2)10-11-13/h5-10H,3-4,11H2,1-2H3/b7-5-,8-6-,12-10-,13-9-
InChIKeyJQNJUULYZLQGSW-DOBIPFTLSA-N
XLogP4.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.29
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethylcyclopenta-1,3-diene
CID 528166
bis(1-ethylcyclopenta-1,3-diene);ruthenium
CID 12730332
1-ethylcyclopenta-1,3-diene;1H-pyrrole
CID 161342493
ethane;ethene;3-methylcyclohepta-1,3,5-triene
CID 144635732
1-ethylcyclohepta-1,3,5-triene;methane
CID 145260552
ethane;1-ethylcyclohepta-1,3,5-triene
CID 142143578
ethane;3-ethoxycyclohepta-1,3,5-triene
CID 142833212
3-methyl-1-propylcyclopenta-1,3-diene
CID 18314972
2-(4-ethylcyclohepta-1,4,6-trien-1-yl)acetyl chloride
CID 91375491
ethane;methane;1-methylcyclopenta-1,3-diene;2-methylcyclopenta-1,3-diene;toluene
CID 159843213
1-N,5-N-di(cyclohepta-1,3,6-trien-1-yl)-2,4,6-triethyl-1-N,3-N,3-N,5-N-tetraphenylbenzene-1,3,5-triamine
CID 129146041
3-(4-ethylphenyl)cyclohepta-1,3,5-triene
CID 143911712

Frequently Asked Questions

What is the IUPAC name of (1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene?
The IUPAC name of (1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene (CID 144855425) is (1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene.
What is the SMILES notation for (1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene?
The canonical SMILES for (1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene is CC/C1=C/C=C\C/C=C\C(C)=C/C1.
What is the InChIKey of (1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene?
The InChIKey is JQNJUULYZLQGSW-DOBIPFTLSA-N. The full InChI is InChI=1S/C13H18/c1-3-13-9-7-5-4-6-8-12(2)10-11-13/h5-10H,3-4,11H2,1-2H3/b7-5-,8-6-,12-10-,13-9-.
What are the key properties of (1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene?
(1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene has a molecular weight of 174.29 g/mol, XLogP of 4.18, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z,6Z,8Z)-1-ethyl-8-methylcyclodeca-1,3,6,8-tetraene is sourced from PubChem (CID 144855425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).