1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene

C16H16 — CID 145232469

IUPAC1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene
SMILESC/C=c1/cccc/c1=C\c1ccc(C)cc1
InChIInChI=1S/C16H16/c1-3-15-6-4-5-7-16(15)12-14-10-8-13(2)9-11-14/h3-12H,1-2H3/b15-3-,16-12+
InChIKeyNDFRMNMSMDMVIA-FPYFXDNASA-N
MW208.30 g/mol
LogP2.62
Rot. Bonds1

About 1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene

1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene (PubChem CID 145232469) has the molecular formula C16H16 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene.

Molecular Properties

Compound Name1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene
PubChem CID145232469
Molecular FormulaC16H16
Molecular Weight208.30 g/mol
Exact Mass208.13
IUPAC Name1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene
SMILESC/C=c1/cccc/c1=C\c1ccc(C)cc1
InChIInChI=1S/C16H16/c1-3-15-6-4-5-7-16(15)12-14-10-8-13(2)9-11-14/h3-12H,1-2H3/b15-3-,16-12+
InChIKeyNDFRMNMSMDMVIA-FPYFXDNASA-N
XLogP2.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;ethane
CID 123449612
(5Z,6Z)-5,6-di(ethylidene)cyclohexa-1,3-diene;(2Z,4Z)-hexa-2,4-diene;methane
CID 161028149
methane;1-methyl-4-[(E)-2-phenylethenyl]benzene
CID 144677664
(3E)-1-methyl-3-[(4-methylphenyl)methylidene]-1,2-benzothiazole 1-oxide
CID 177457671
N-methyl-1-(4-methylphenyl)methanimine
CID 11208221
1-ethenyl-4-methylbenzene;styrene
CID 159659441
(4-methylphenyl)-diphenyl-[4-[(E)-prop-1-enyl]phenyl]silane
CID 23550529
benzene;bis(1,4-xylene)
CID 159472747
ethane;1-methyl-4-[2-(4-methylphenyl)ethenyl]benzene
CID 91206086
ethane;1-methyl-4-[2-(4-methylphenyl)ethenyl]benzene
CID 90770914
1-methyl-4-(3-phenylpropa-1,2-dienyl)benzene
CID 10262404
1,3-bis[(4-methylphenyl)methylidene]-2,2-diphenylindene
CID 59935177

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene?
The IUPAC name of 1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene (CID 145232469) is 1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene.
What is the SMILES notation for 1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene?
The canonical SMILES for 1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene is C/C=c1/cccc/c1=C\c1ccc(C)cc1.
What is the InChIKey of 1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene?
The InChIKey is NDFRMNMSMDMVIA-FPYFXDNASA-N. The full InChI is InChI=1S/C16H16/c1-3-15-6-4-5-7-16(15)12-14-10-8-13(2)9-11-14/h3-12H,1-2H3/b15-3-,16-12+.
What are the key properties of 1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene?
1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene has a molecular weight of 208.30 g/mol, XLogP of 2.62, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]-4-methylbenzene is sourced from PubChem (CID 145232469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).