(6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene

C9H12 — CID 163873761

IUPAC(6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene
SMILESC/C=C1\C=C(C)C=CC1
InChIInChI=1S/C9H12/c1-3-9-6-4-5-8(2)7-9/h3-5,7H,6H2,1-2H3/b9-3-
InChIKeyPNCDTNKFLFLUBX-OQFOIZHKSA-N
MW120.19 g/mol
LogP2.84
Rot. Bonds

About (6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene

(6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene (PubChem CID 163873761) has the molecular formula C9H12 and a molecular weight of 120.19 g/mol. Its IUPAC name is (6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene.

Molecular Properties

Compound Name(6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene
PubChem CID163873761
Molecular FormulaC9H12
Molecular Weight120.19 g/mol
Exact Mass120.09
IUPAC Name(6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene
SMILESC/C=C1\C=C(C)C=CC1
InChIInChI=1S/C9H12/c1-3-9-6-4-5-8(2)7-9/h3-5,7H,6H2,1-2H3/b9-3-
InChIKeyPNCDTNKFLFLUBX-OQFOIZHKSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.19
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

5-ethylidene-2-methylcyclohexa-1,3-diene
CID 136594960
(2,4-dimethylcyclohepta-1,3,5-trien-1-yl)phosphane
CID 123672408
2-ethenyl-N,N,6-trimethylcyclohepta-1,4,6-trien-1-amine
CID 143195302
ethane;(11E)-11-ethylidene-9-methyl-6H-cyclohepta[b]thiochromene
CID 143426526
acetaldehyde;4-methylcyclohepta-1,3,5-trien-1-amine
CID 143275435
6-butan-2-ylidene-2-methylcyclohexa-1,3-diene
CID 123474573
(6E)-6-ethylidene-1-methylcyclohexa-1,3-diene
CID 169152065
acetaldehyde;2-methylcyclohexa-1,3-diene
CID 144635088
4-methylcyclohepta-1,3,5-trien-1-amine;molecular hydrogen
CID 143190843
4-methylcyclohepta-1,3,5-triene-1-carbonitrile
CID 18343928
2-trimethylsilylcyclopenta-1,3-diene-1-carbaldehyde
CID 15205236
(E)-cyclobut-2-en-1-ylidenemethanamine
CID 147295105

Frequently Asked Questions

What is the IUPAC name of (6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene?
The IUPAC name of (6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene (CID 163873761) is (6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene.
What is the SMILES notation for (6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene?
The canonical SMILES for (6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene is C/C=C1\C=C(C)C=CC1.
What is the InChIKey of (6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene?
The InChIKey is PNCDTNKFLFLUBX-OQFOIZHKSA-N. The full InChI is InChI=1S/C9H12/c1-3-9-6-4-5-8(2)7-9/h3-5,7H,6H2,1-2H3/b9-3-.
What are the key properties of (6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene?
(6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene has a molecular weight of 120.19 g/mol, XLogP of 2.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene is sourced from PubChem (CID 163873761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).