1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene

C20H24 — CID 143846029

IUPAC1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene
SMILESC=Cc1c(C)c(/C=C\C)c(/C=C\C)c(C=C)c1/C=C\C
InChIInChI=1S/C20H24/c1-7-12-18-15(6)16(10-4)19(13-8-2)17(11-5)20(18)14-9-3/h7-14H,4-5H2,1-3,6H3/b12-7-,13-8-,14-9-
InChIKeyUPXKXNKWWROINW-PEKHUZIYSA-N
MW264.41 g/mol
LogP6.38
Rot. Bonds5

About 1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene

1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene (PubChem CID 143846029) has the molecular formula C20H24 and a molecular weight of 264.41 g/mol. Its IUPAC name is 1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene.

Molecular Properties

Compound Name1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene
PubChem CID143846029
Molecular FormulaC20H24
Molecular Weight264.41 g/mol
Exact Mass264.19
IUPAC Name1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene
SMILESC=Cc1c(C)c(/C=C\C)c(/C=C\C)c(C=C)c1/C=C\C
InChIInChI=1S/C20H24/c1-7-12-18-15(6)16(10-4)19(13-8-2)17(11-5)20(18)14-9-3/h7-14H,4-5H2,1-3,6H3/b12-7-,13-8-,14-9-
InChIKeyUPXKXNKWWROINW-PEKHUZIYSA-N
XLogP6.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.41
LogP ≤ 56.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene?
The IUPAC name of 1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene (CID 143846029) is 1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene.
What is the SMILES notation for 1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene?
The canonical SMILES for 1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene is C=Cc1c(C)c(/C=C\C)c(/C=C\C)c(C=C)c1/C=C\C.
What is the InChIKey of 1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene?
The InChIKey is UPXKXNKWWROINW-PEKHUZIYSA-N. The full InChI is InChI=1S/C20H24/c1-7-12-18-15(6)16(10-4)19(13-8-2)17(11-5)20(18)14-9-3/h7-14H,4-5H2,1-3,6H3/b12-7-,13-8-,14-9-.
What are the key properties of 1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene?
1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene has a molecular weight of 264.41 g/mol, XLogP of 6.38, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene is sourced from PubChem (CID 143846029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).