2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene

C19H24 — CID 91665788

IUPAC2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene
SMILESCCc1ccc(-c2c(C)cc(C)cc2C)cc1CC
InChIInChI=1S/C19H24/c1-6-16-8-9-18(12-17(16)7-2)19-14(4)10-13(3)11-15(19)5/h8-12H,6-7H2,1-5H3
InChIKeyKXDNPANIUQTPDU-UHFFFAOYSA-N
MW252.40 g/mol
LogP5.40
Rot. Bonds3

About 2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene

2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene (PubChem CID 91665788) has the molecular formula C19H24 and a molecular weight of 252.40 g/mol. Its IUPAC name is 2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene.

Molecular Properties

Compound Name2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene
PubChem CID91665788
Molecular FormulaC19H24
Molecular Weight252.40 g/mol
Exact Mass252.19
IUPAC Name2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene
SMILESCCc1ccc(-c2c(C)cc(C)cc2C)cc1CC
InChIInChI=1S/C19H24/c1-6-16-8-9-18(12-17(16)7-2)19-14(4)10-13(3)11-15(19)5/h8-12H,6-7H2,1-5H3
InChIKeyKXDNPANIUQTPDU-UHFFFAOYSA-N
XLogP5.40
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 ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethyl-2,4-dimethylbenzene;propane
CID 143347602
2-(2,6-diethylphenyl)-1,3,5-trimethylbenzene
CID 91665787
1,2-diethyl-4-methylbenzene;methane
CID 174446118
1-(3-chloro-4-ethylphenyl)-2,4-dimethylbenzene
CID 129016588
3-(3,4-diethylphenyl)-4-ethylbenzene-1,2-diol
CID 101302818
2-ethyl-1-methyl-4-(4-methylphenyl)benzene
CID 59090118
5-(3,4-diethylphenyl)-2-ethylphenol
CID 101302461
2-(3,5-dimethylphenyl)-1,3,5-triethylbenzene
CID 123795818
1,4-diphenyl-2,3,5,6-tetrakis[4-(2,4,6-trimethylphenyl)phenyl]benzene
CID 135033708
2-(4-iodophenyl)-1,3,5-trimethylbenzene
CID 71396711
2-(3,4-diethylphenyl)-5-methylbenzoic acid
CID 115482487
methyl 2-[4-(2,4,6-trimethylphenyl)phenyl]acetate
CID 143366295

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene?
The IUPAC name of 2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene (CID 91665788) is 2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene.
What is the SMILES notation for 2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene?
The canonical SMILES for 2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene is CCc1ccc(-c2c(C)cc(C)cc2C)cc1CC.
What is the InChIKey of 2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene?
The InChIKey is KXDNPANIUQTPDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24/c1-6-16-8-9-18(12-17(16)7-2)19-14(4)10-13(3)11-15(19)5/h8-12H,6-7H2,1-5H3.
What are the key properties of 2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene?
2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene has a molecular weight of 252.40 g/mol, XLogP of 5.40, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-diethylphenyl)-1,3,5-trimethylbenzene is sourced from PubChem (CID 91665788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).