2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene

C20H26 — CID 123795818

IUPAC2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene
SMILESCCc1cc(CC)c(-c2cc(C)cc(C)c2)c(CC)c1
InChIInChI=1S/C20H26/c1-6-16-12-17(7-2)20(18(8-3)13-16)19-10-14(4)9-15(5)11-19/h9-13H,6-8H2,1-5H3
InChIKeyMYLYMLPIQIPXNI-UHFFFAOYSA-N
MW266.43 g/mol
LogP5.66
Rot. Bonds4

About 2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene

2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene (PubChem CID 123795818) has the molecular formula C20H26 and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene.

Molecular Properties

Compound Name2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene
PubChem CID123795818
Molecular FormulaC20H26
Molecular Weight266.43 g/mol
Exact Mass266.20
IUPAC Name2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene
SMILESCCc1cc(CC)c(-c2cc(C)cc(C)c2)c(CC)c1
InChIInChI=1S/C20H26/c1-6-16-12-17(7-2)20(18(8-3)13-16)19-10-14(4)9-15(5)11-19/h9-13H,6-8H2,1-5H3
InChIKeyMYLYMLPIQIPXNI-UHFFFAOYSA-N
XLogP5.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.43
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethyl-3,5-dimethylbenzene;2-ethyl-1,4-dimethylbenzene
CID 160945990
2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene
CID 91665788
5-[(3,5-dimethylphenyl)methyl]-1,3-diethyl-2-methylbenzene
CID 145013287
(2,4,6-triethylphenyl)aluminum(2+)
CID 22768319
1-[(3,5-diethylphenyl)methyl]-3-ethyl-5-[(3-ethyl-5-methylphenyl)methyl]benzene
CID 159034335
bis(1-ethyl-3,5-dimethylbenzene);naphthalene
CID 165102980
1-(2,4,6-triethylphenyl)-4-[4-(2,4,6-triethylphenyl)naphthalen-1-yl]naphthalene
CID 102266833
3,5-diethyl-2-methylaniline
CID 105432272
2-ethyl-1-methyl-4-(4-methylphenyl)benzene
CID 59090118
1,3,5-triethyl-2-[2-iodo-3-(2,4,6-triethylphenyl)phenyl]benzene
CID 163342457
2,4-diethyl-1-(4-ethylphenyl)benzene
CID 102240206
cobalt(3+);1-[4-methyl-6-[C-methyl-N-(2,4,6-triethylphenyl)carbonimidoyl]-2-pyridinyl]-N-(2,4,6-triethylphenyl)ethanimine;trichloride
CID 173244057

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene?
The IUPAC name of 2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene (CID 123795818) is 2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene.
What is the SMILES notation for 2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene?
The canonical SMILES for 2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene is CCc1cc(CC)c(-c2cc(C)cc(C)c2)c(CC)c1.
What is the InChIKey of 2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene?
The InChIKey is MYLYMLPIQIPXNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26/c1-6-16-12-17(7-2)20(18(8-3)13-16)19-10-14(4)9-15(5)11-19/h9-13H,6-8H2,1-5H3.
What are the key properties of 2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene?
2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene has a molecular weight of 266.43 g/mol, XLogP of 5.66, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene is sourced from PubChem (CID 123795818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).