ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene

C19H24 — CID 153375358

IUPACethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene
SMILESC=C(Cc1ccc(C)cc1)c1ccc(C)cc1.CC
InChIInChI=1S/C17H18.C2H6/c1-13-4-8-16(9-5-13)12-15(3)17-10-6-14(2)7-11-17;1-2/h4-11H,3,12H2,1-2H3;1-2H3
InChIKeyJRQVQVGSUCYJMI-UHFFFAOYSA-N
MW252.40 g/mol
LogP5.59
Rot. Bonds3

About ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene

ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene (PubChem CID 153375358) has the molecular formula C19H24 and a molecular weight of 252.40 g/mol. Its IUPAC name is ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene.

Molecular Properties

Compound Nameethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene
PubChem CID153375358
Molecular FormulaC19H24
Molecular Weight252.40 g/mol
Exact Mass252.19
IUPAC Nameethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene
SMILESC=C(Cc1ccc(C)cc1)c1ccc(C)cc1.CC
InChIInChI=1S/C17H18.C2H6/c1-13-4-8-16(9-5-13)12-15(3)17-10-6-14(2)7-11-17;1-2/h4-11H,3,12H2,1-2H3;1-2H3
InChIKeyJRQVQVGSUCYJMI-UHFFFAOYSA-N
XLogP5.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.40
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methyl-4-(3-phenylprop-1-en-2-yl)benzene
CID 134964621
1-methyl-4-[7-(4-methylphenyl)octa-1,7-dien-2-yl]benzene
CID 15247721
1,4-bis[1-(4-methylphenyl)ethenyl]benzene;ethane
CID 123373957
1-(2-phenylprop-2-enyl)-4-propylbenzene
CID 57162599
1-methyl-4-(4,4,4-trifluorobut-1-en-2-yl)benzene
CID 122397383
1-methyl-4-[2-[2-(3-phenylprop-1-en-2-yl)phenyl]ethyl]benzene
CID 140698702
1-methyl-4-(7-methylocta-1,7-dien-2-yl)benzene
CID 143865907
ethane;methyl 2-[4-[3-[4-(2-phenylacetyl)phenyl]prop-1-en-2-yl]phenyl]acetate
CID 145312814
ethane;1-methyl-4-[(2Z)-2-prop-1-en-2-ylpenta-2,4-dienyl]benzene
CID 166162236
1-dec-1-en-2-yl-4-methylbenzene
CID 3805374
cyclobutane;ethane;1-methyl-4-prop-1-en-2-ylbenzene
CID 177043562
N,N-dimethyl-2-(4-methylphenyl)acetamide
CID 4048798

Frequently Asked Questions

What is the IUPAC name of ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene?
The IUPAC name of ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene (CID 153375358) is ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene.
What is the SMILES notation for ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene?
The canonical SMILES for ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene is C=C(Cc1ccc(C)cc1)c1ccc(C)cc1.CC.
What is the InChIKey of ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene?
The InChIKey is JRQVQVGSUCYJMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18.C2H6/c1-13-4-8-16(9-5-13)12-15(3)17-10-6-14(2)7-11-17;1-2/h4-11H,3,12H2,1-2H3;1-2H3.
What are the key properties of ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene?
ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene has a molecular weight of 252.40 g/mol, XLogP of 5.59, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methyl-4-[2-(4-methylphenyl)prop-2-enyl]benzene is sourced from PubChem (CID 153375358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).