1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene

C18H20 — CID 90922065

IUPAC1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene
SMILESCC=C(c1ccccc1C)c1cc(C)ccc1C
InChIInChI=1S/C18H20/c1-5-16(17-9-7-6-8-14(17)3)18-12-13(2)10-11-15(18)4/h5-12H,1-4H3
InChIKeyDHYXISGJEJQEEV-UHFFFAOYSA-N
MW236.36 g/mol
LogP5.06
Rot. Bonds2

About 1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene

1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene (PubChem CID 90922065) has the molecular formula C18H20 and a molecular weight of 236.36 g/mol. Its IUPAC name is 1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene.

Molecular Properties

Compound Name1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene
PubChem CID90922065
Molecular FormulaC18H20
Molecular Weight236.36 g/mol
Exact Mass236.16
IUPAC Name1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene
SMILESCC=C(c1ccccc1C)c1cc(C)ccc1C
InChIInChI=1S/C18H20/c1-5-16(17-9-7-6-8-14(17)3)18-12-13(2)10-11-15(18)4/h5-12H,1-4H3
InChIKeyDHYXISGJEJQEEV-UHFFFAOYSA-N
XLogP5.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.36
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methyl-2-(1-phenylprop-1-enyl)benzene
CID 54442405
1,4-dimethyl-2-[(1E)-1-phenylbuta-1,3-dienyl]benzene
CID 102501340
1,4-dimethyl-2-[(1Z)-3-methyl-1-phenylbuta-1,3-dienyl]benzene
CID 142303398
(Z)-1-(2,5-dimethylphenyl)prop-1-en-1-amine
CID 144516209
(Z)-1,2-bis(2,5-dimethylphenyl)ethene-1,2-diol
CID 126634568
3,3-bis(2,5-dimethylphenyl)-N,N-dimethylprop-2-enamide
CID 102204543
1-[(E)-but-2-en-2-yl]-2-methylbenzene
CID 12835573
(Z)-2-(2,5-dimethylphenyl)but-2-enenitrile
CID 82074810
(Z)-2-(2,5-dimethylphenyl)-3-(2-methylphenyl)prop-2-enoic acid
CID 83954371
2,5-dimethyl-N-(2-methylphenyl)benzamide
CID 925354
(E)-1-(2-methylphenyl)prop-1-ene-1-thiol
CID 142259115
(Z)-1-(2-methylphenyl)prop-1-en-1-amine
CID 126678655

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene?
The IUPAC name of 1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene (CID 90922065) is 1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene.
What is the SMILES notation for 1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene?
The canonical SMILES for 1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene is CC=C(c1ccccc1C)c1cc(C)ccc1C.
What is the InChIKey of 1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene?
The InChIKey is DHYXISGJEJQEEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20/c1-5-16(17-9-7-6-8-14(17)3)18-12-13(2)10-11-15(18)4/h5-12H,1-4H3.
What are the key properties of 1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene?
1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene has a molecular weight of 236.36 g/mol, XLogP of 5.06, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-2-[1-(2-methylphenyl)prop-1-enyl]benzene is sourced from PubChem (CID 90922065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).