(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane

C12H18 — CID 123449612

IUPAC(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane
SMILESC/C=c1/cccc/c1=C/C.CC
InChIInChI=1S/C10H12.C2H6/c1-3-9-7-5-6-8-10(9)4-2;1-2/h3-8H,1-2H3;1-2H3/b9-3-,10-4-;
InChIKeyTWOSVNUGBFVRKP-NALDQGCSSA-N
MW162.28 g/mol
LogP2.31
Rot. Bonds

About (5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane

(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane (PubChem CID 123449612) has the molecular formula C12H18 and a molecular weight of 162.28 g/mol. Its IUPAC name is (5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane.

Molecular Properties

Compound Name(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane
PubChem CID123449612
Molecular FormulaC12H18
Molecular Weight162.28 g/mol
Exact Mass162.14
IUPAC Name(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane
SMILESC/C=c1/cccc/c1=C/C.CC
InChIInChI=1S/C10H12.C2H6/c1-3-9-7-5-6-8-10(9)4-2;1-2/h3-8H,1-2H3;1-2H3/b9-3-,10-4-;
InChIKeyTWOSVNUGBFVRKP-NALDQGCSSA-N
XLogP2.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;(2Z,4Z)-hexa-2,4-diene;methane
CID 161028149
(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methanamine
CID 88997175
1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene
CID 145232469
(1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine
CID 144667223
(5Z,6Z)-5-ethylidene-6-[(E)-2-methylpent-2-enylidene]cyclohexa-1,3-diene
CID 162733287
2,3-di(ethylidene)tetracene
CID 123900785
(5Z,6Z)-5-ethylidene-6-[(Z)-pent-3-en-2-ylidene]cyclohexa-1,3-diene
CID 145127777
(1E)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]propane-1-thiol
CID 137427905
benzene;1,1'-biphenyl;(E)-but-2-ene;ethane
CID 161147131
3-ethylidene-2-(2-methylbut-2-enylidene)pyridine
CID 90959337
ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyridine
CID 142972372
1,1'-biphenyl;ethane;prop-1-ene
CID 156726173

Frequently Asked Questions

What is the IUPAC name of (5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane?
The IUPAC name of (5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane (CID 123449612) is (5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane.
What is the SMILES notation for (5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane?
The canonical SMILES for (5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane is C/C=c1/cccc/c1=C/C.CC.
What is the InChIKey of (5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane?
The InChIKey is TWOSVNUGBFVRKP-NALDQGCSSA-N. The full InChI is InChI=1S/C10H12.C2H6/c1-3-9-7-5-6-8-10(9)4-2;1-2/h3-8H,1-2H3;1-2H3/b9-3-,10-4-;.
What are the key properties of (5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane?
(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane has a molecular weight of 162.28 g/mol, XLogP of 2.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane is sourced from PubChem (CID 123449612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).