1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane

C22H30 — CID 144583365

IUPAC1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane
SMILESC=Cc1cc(C)c(-c2ccc(C)cc2)cc1C=C.CC.CC
InChIInChI=1S/C18H18.2C2H6/c1-5-15-11-14(4)18(12-16(15)6-2)17-9-7-13(3)8-10-17;2*1-2/h5-12H,1-2H2,3-4H3;2*1-2H3
InChIKeyQORAQJYNUOQTRY-UHFFFAOYSA-N
MW294.48 g/mol
LogP7.31
Rot. Bonds3

About 1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane

1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane (PubChem CID 144583365) has the molecular formula C22H30 and a molecular weight of 294.48 g/mol. Its IUPAC name is 1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane.

Molecular Properties

Compound Name1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane
PubChem CID144583365
Molecular FormulaC22H30
Molecular Weight294.48 g/mol
Exact Mass294.23
IUPAC Name1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane
SMILESC=Cc1cc(C)c(-c2ccc(C)cc2)cc1C=C.CC.CC
InChIInChI=1S/C18H18.2C2H6/c1-5-15-11-14(4)18(12-16(15)6-2)17-9-7-13(3)8-10-17;2*1-2/h5-12H,1-2H2,3-4H3;2*1-2H3
InChIKeyQORAQJYNUOQTRY-UHFFFAOYSA-N
XLogP7.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.48
LogP ≤ 57.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,2-bis(ethenyl)-4-methylbenzene;ethane;prop-1-ene
CID 143109354
1,2,4-tris(ethenyl)-5-methylbenzene
CID 59335502
1-ethenyl-2,4-dimethylbenzene
CID 157285903
1,2-bis(ethenyl)-4-methylbenzene;ethane;methane;prop-1-ene
CID 143109411
3,4-bis(ethenyl)-5-(4-methylphenyl)pyridine
CID 144591964
ethane;2-ethenyl-4-methyl-1-[(Z)-prop-1-enyl]benzene
CID 172609650
1,2-bis(ethenyl)-4-methylbenzene;methoxymethane
CID 142804443
7-ethenyl-5-methylcyclopenta[c]thiopyran
CID 174847681
2-ethenyl-3-fluoro-1-methyl-4-(4-methylphenyl)benzene
CID 142004346
1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene
CID 123748481
4-[2,5-dimethyl-4-(4-methylphenyl)phenyl]benzoic acid
CID 154692263
3-methyl-4-(4-methylphenyl)benzaldehyde
CID 81447593

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane?
The IUPAC name of 1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane (CID 144583365) is 1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane.
What is the SMILES notation for 1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane?
The canonical SMILES for 1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane is C=Cc1cc(C)c(-c2ccc(C)cc2)cc1C=C.CC.CC.
What is the InChIKey of 1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane?
The InChIKey is QORAQJYNUOQTRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18.2C2H6/c1-5-15-11-14(4)18(12-16(15)6-2)17-9-7-13(3)8-10-17;2*1-2/h5-12H,1-2H2,3-4H3;2*1-2H3.
What are the key properties of 1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane?
1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane has a molecular weight of 294.48 g/mol, XLogP of 7.31, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(ethenyl)-4-methyl-5-(4-methylphenyl)benzene;ethane is sourced from PubChem (CID 144583365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).