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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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).