ethene;1-methyl-2-(2-methylphenyl)benzene

C16H18 — CID 145078997

IUPACethene;1-methyl-2-(2-methylphenyl)benzene
SMILESC=C.Cc1ccccc1-c1ccccc1C
InChIInChI=1S/C14H14.C2H4/c1-11-7-3-5-9-13(11)14-10-6-4-8-12(14)2;1-2/h3-10H,1-2H3;1-2H2
InChIKeyLAGUMNPUFIMXLB-UHFFFAOYSA-N
MW210.32 g/mol
LogP4.77
Rot. Bonds1

About ethene;1-methyl-2-(2-methylphenyl)benzene

ethene;1-methyl-2-(2-methylphenyl)benzene (PubChem CID 145078997) has the molecular formula C16H18 and a molecular weight of 210.32 g/mol. Its IUPAC name is ethene;1-methyl-2-(2-methylphenyl)benzene.

Molecular Properties

Compound Nameethene;1-methyl-2-(2-methylphenyl)benzene
PubChem CID145078997
Molecular FormulaC16H18
Molecular Weight210.32 g/mol
Exact Mass210.14
IUPAC Nameethene;1-methyl-2-(2-methylphenyl)benzene
SMILESC=C.Cc1ccccc1-c1ccccc1C
InChIInChI=1S/C14H14.C2H4/c1-11-7-3-5-9-13(11)14-10-6-4-8-12(14)2;1-2/h3-10H,1-2H3;1-2H2
InChIKeyLAGUMNPUFIMXLB-UHFFFAOYSA-N
XLogP4.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethene;1-methyl-2-(2-methylphenyl)benzene?
The IUPAC name of ethene;1-methyl-2-(2-methylphenyl)benzene (CID 145078997) is ethene;1-methyl-2-(2-methylphenyl)benzene.
What is the SMILES notation for ethene;1-methyl-2-(2-methylphenyl)benzene?
The canonical SMILES for ethene;1-methyl-2-(2-methylphenyl)benzene is C=C.Cc1ccccc1-c1ccccc1C.
What is the InChIKey of ethene;1-methyl-2-(2-methylphenyl)benzene?
The InChIKey is LAGUMNPUFIMXLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14.C2H4/c1-11-7-3-5-9-13(11)14-10-6-4-8-12(14)2;1-2/h3-10H,1-2H3;1-2H2.
What are the key properties of ethene;1-methyl-2-(2-methylphenyl)benzene?
ethene;1-methyl-2-(2-methylphenyl)benzene has a molecular weight of 210.32 g/mol, XLogP of 4.77, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;1-methyl-2-(2-methylphenyl)benzene is sourced from PubChem (CID 145078997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).