1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane

C136H224F9NO14S7-6 — CID 160938413

About 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane

1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane (PubChem CID 160938413) has the molecular formula C136H224F9NO14S7-6 and a molecular weight of 2492.73 g/mol. Its IUPAC name is 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane.

Molecular Properties

• Compound Name: 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane
• PubChem CID: 160938413
• Molecular Formula: C136H224F9NO14S7-6
• Molecular Weight: 2492.73 g/mol
• Exact Mass: 2490.48
• IUPAC Name: 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane
• SMILES: CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC1CCC(C)[C@H](C)C1.CC1CCCCC1.CC1CCCCC1.CC1CCCCC1.CC1CCCCC1.CC1CCCCC1.CCc1ccc(-c2cc(C)cs2)cc1C.CCc1ccc(C(F)(F)F)c(CC)c1.CCc1ccc(C(F)(F)F)cc1.CCc1ccc(OC2CCC(C)C2C)cc1.CCc1ccc(OC2CCCC2)c(CC)c1.CCc1ncc(C(F)(F)F)c(C)c1C
• InChI: InChI=1S/2C15H22O.C14H16S.C11H13F3.C10H12F3N.C9H9F3.C9H18.5C7H14.6C3H8O2S/c1-4-13-6-8-14(9-7-13)16-15-10-5-11(2)12(15)3;1-3-12-9-10-15(13(4-2)11-12)16-14-7-5-6-8-14;1-4-12-5-6-13(8-11(12)3)14-7-10(2)9-15-14;1-3-8-5-6-10(11(12,13)14)9(4-2)7-8;1-4-9-7(3)6(2)8(5-14-9)10(11,12)13;1-2-7-3-5-8(6-4-7)9(10,11)12;1-7-4-5-8(2)9(3)6-7;5*1-7-5-3-2-4-6-7;6*1-3(2)6(4)5/h6-9,11-12,15H,4-5,10H2,1-3H3;9-11,14H,3-8H2,1-2H3;5-9H,4H2,1-3H3;5-7H,3-4H2,1-2H3;5H,4H2,1-3H3;3-6H,2H2,1H3;7-9H,4-6H2,1-3H3;5*7H,2-6H2,1H3;6*3H,1-2H3,(H,4,5)/p-6/t;;;;;;7?,8?,9-;;;;;;;;;;;/m......1.........../s1
• InChIKey: ARHWDVOOASPQJI-PCPAZIJMSA-H
• XLogP: 40.82
• TPSA: 272.13 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 19
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2492.73
LogP ≤ 5	40.82
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane?

The IUPAC name of 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane (CID 160938413) is 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane.

What is the SMILES notation for 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane?

The canonical SMILES for 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane is CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC(C)S(=O)[O-].CC1CCC(C)[C@H](C)C1.CC1CCCCC1.CC1CCCCC1.CC1CCCCC1.CC1CCCCC1.CC1CCCCC1.CCc1ccc(-c2cc(C)cs2)cc1C.CCc1ccc(C(F)(F)F)c(CC)c1.CCc1ccc(C(F)(F)F)cc1.CCc1ccc(OC2CCC(C)C2C)cc1.CCc1ccc(OC2CCCC2)c(CC)c1.CCc1ncc(C(F)(F)F)c(C)c1C.

What is the InChIKey of 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane?

The InChIKey is ARHWDVOOASPQJI-PCPAZIJMSA-H. The full InChI is InChI=1S/2C15H22O.C14H16S.C11H13F3.C10H12F3N.C9H9F3.C9H18.5C7H14.6C3H8O2S/c1-4-13-6-8-14(9-7-13)16-15-10-5-11(2)12(15)3;1-3-12-9-10-15(13(4-2)11-12)16-14-7-5-6-8-14;1-4-12-5-6-13(8-11(12)3)14-7-10(2)9-15-14;1-3-8-5-6-10(11(12,13)14)9(4-2)7-8;1-4-9-7(3)6(2)8(5-14-9)10(11,12)13;1-2-7-3-5-8(6-4-7)9(10,11)12;1-7-4-5-8(2)9(3)6-7;5*1-7-5-3-2-4-6-7;6*1-3(2)6(4)5/h6-9,11-12,15H,4-5,10H2,1-3H3;9-11,14H,3-8H2,1-2H3;5-9H,4H2,1-3H3;5-7H,3-4H2,1-2H3;5H,4H2,1-3H3;3-6H,2H2,1H3;7-9H,4-6H2,1-3H3;5*7H,2-6H2,1H3;6*3H,1-2H3,(H,4,5)/p-6/t;;;;;;7?,8?,9-;;;;;;;;;;;/m......1.........../s1.

What are the key properties of 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane?

1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane has a molecular weight of 2492.73 g/mol, XLogP of 40.82, 19 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopentyloxy-2,4-diethylbenzene;2,4-diethyl-1-(trifluoromethyl)benzene;1-(2,3-dimethylcyclopentyl)oxy-4-ethylbenzene;2-ethyl-3,4-dimethyl-5-(trifluoromethyl)pyridine;2-(4-ethyl-3-methylphenyl)-4-methylthiophene;1-ethyl-4-(trifluoromethyl)benzene;pentakis(methylcyclohexane);hexakis(propane-2-sulfinate);(2R)-1,2,4-trimethylcyclohexane is sourced from PubChem (CID 160938413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).