(1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene

C11H16 — CID 145266562

IUPAC(1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene
SMILESCC1=CCC(C)/C(C)=C\C=C/1
InChIInChI=1S/C11H16/c1-9-5-4-6-10(2)11(3)8-7-9/h4-7,11H,8H2,1-3H3/b5-4-,9-7?,10-6-
InChIKeyLTQADRAKNDIFRH-WLVSSHDHSA-N
MW148.25 g/mol
LogP3.47
Rot. Bonds

About (1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene

(1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene (PubChem CID 145266562) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is (1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene.

Molecular Properties

Compound Name(1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene
PubChem CID145266562
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name(1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene
SMILESCC1=CCC(C)/C(C)=C\C=C/1
InChIInChI=1S/C11H16/c1-9-5-4-6-10(2)11(3)8-7-9/h4-7,11H,8H2,1-3H3/b5-4-,9-7?,10-6-
InChIKeyLTQADRAKNDIFRH-WLVSSHDHSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1E)-1,5,10-trimethylcyclododeca-1,3,5-triene
CID 173082678
(6S)-1,6-dimethyl-3-nitrosocyclohexa-1,3-diene
CID 163581000
1,6-dimethyl-5-methylidenecyclohexa-1,3-diene
CID 141384688
1,4,7-trimethylcycloheptene
CID 123852722
5-iodo-2-methylcyclohexa-1,3-diene
CID 70252237
1,6,7-trimethylcyclohepta-1,3,5-triene
CID 123961293
5-butyl-2-methylcyclohexa-1,3-diene
CID 12596747
1,6-dimethyl-3-prop-1-en-2-ylcyclohexa-1,3-diene;ethane
CID 156650875
(5S)-5-ethoxy-2-methylcyclohexa-1,3-diene
CID 89420040
5-methyl-N,N-diphenylcyclohepta-1,3,5-trien-1-amine
CID 144696503
(4S)-4-methylcyclobuten-1-amine
CID 164996658
N,N,4-trimethylcyclohexa-2,4-dien-1-amine
CID 89017646

Frequently Asked Questions

What is the IUPAC name of (1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene?
The IUPAC name of (1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene (CID 145266562) is (1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene.
What is the SMILES notation for (1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene?
The canonical SMILES for (1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene is CC1=CCC(C)/C(C)=C\C=C/1.
What is the InChIKey of (1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene?
The InChIKey is LTQADRAKNDIFRH-WLVSSHDHSA-N. The full InChI is InChI=1S/C11H16/c1-9-5-4-6-10(2)11(3)8-7-9/h4-7,11H,8H2,1-3H3/b5-4-,9-7?,10-6-.
What are the key properties of (1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene?
(1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene has a molecular weight of 148.25 g/mol, XLogP of 3.47, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z)-1,5,8-trimethylcycloocta-1,3,5-triene is sourced from PubChem (CID 145266562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).