bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane

C109H150O2 — CID 160549022

About bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane

bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane (PubChem CID 160549022) has the molecular formula C109H150O2 and a molecular weight of 1492.40 g/mol. Its IUPAC name is bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane.

Molecular Properties

• Compound Name: bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane
• PubChem CID: 160549022
• Molecular Formula: C109H150O2
• Molecular Weight: 1492.40 g/mol
• Exact Mass: 1491.16
• IUPAC Name: bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane
• SMILES: CC(C)=C(C)C.CC1CC(C)C(C)C1C.CCC(C)C(C)CC.Cc1cc(C)c(C)cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C)c(C)c1C.Cc1cccc(-c2cccc(C)c2C)c1C.Cc1cccc(C(=O)c2cccc(C)c2C)c1C.[H][H]
• InChI: InChI=1S/2C17H18O.2C16H18.2C10H14.C9H18.C8H18.C6H12.H2/c1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-11-7-5-9-15(13(11)3)17(18)16-10-6-8-12(2)14(16)4;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-11-7-5-9-15(13(11)3)16-10-6-8-12(2)14(16)4;1-7-5-9(3)10(4)6-8(7)2;1-7-5-6-8(2)10(4)9(7)3;1-6-5-7(2)9(4)8(6)3;1-5-7(3)8(4)6-2;1-5(2)6(3)4;/h2*5-10H,1-4H3;2*5-10H,1-4H3;2*5-6H,1-4H3;6-9H,5H2,1-4H3;7-8H,5-6H2,1-4H3;1-4H3;1H
• InChIKey: QXUSYFAUGJYDPY-UHFFFAOYSA-N
• XLogP: 31.94
• TPSA: 34.14 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 9
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1492.40
LogP ≤ 5	31.94
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane?

The IUPAC name of bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane (CID 160549022) is bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane.

What is the SMILES notation for bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane?

The canonical SMILES for bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane is CC(C)=C(C)C.CC1CC(C)C(C)C1C.CCC(C)C(C)CC.Cc1cc(C)c(C)cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C)c(C)c1C.Cc1cccc(-c2cccc(C)c2C)c1C.Cc1cccc(C(=O)c2cccc(C)c2C)c1C.[H][H].

What is the InChIKey of bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane?

The InChIKey is QXUSYFAUGJYDPY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C17H18O.2C16H18.2C10H14.C9H18.C8H18.C6H12.H2/c1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-11-7-5-9-15(13(11)3)17(18)16-10-6-8-12(2)14(16)4;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-11-7-5-9-15(13(11)3)16-10-6-8-12(2)14(16)4;1-7-5-9(3)10(4)6-8(7)2;1-7-5-6-8(2)10(4)9(7)3;1-6-5-7(2)9(4)8(6)3;1-5-7(3)8(4)6-2;1-5(2)6(3)4;/h2*5-10H,1-4H3;2*5-10H,1-4H3;2*5-6H,1-4H3;6-9H,5H2,1-4H3;7-8H,5-6H2,1-4H3;1-4H3;1H.

What are the key properties of bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane?

bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane has a molecular weight of 1492.40 g/mol, XLogP of 31.94, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2,3-dimethylphenyl)methanone;bis(3,4-dimethylphenyl)methanone;2,3-dimethylbut-2-ene;3,4-dimethylhexane;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;molecular hydrogen;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;1,2,3,4-tetramethylcyclopentane is sourced from PubChem (CID 160549022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).