1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene

C218H338F25N9O — CID 160939909

About 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene

1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene (PubChem CID 160939909) has the molecular formula C218H338F25N9O and a molecular weight of 3576.11 g/mol. Its IUPAC name is 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene.

Molecular Properties

• Compound Name: 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene
• PubChem CID: 160939909
• Molecular Formula: C218H338F25N9O
• Molecular Weight: 3576.11 g/mol
• Exact Mass: 3573.63
• IUPAC Name: 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene
• SMILES: C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.COc1cc(C)ccc1C.Cc1c(C)c(C)c(C)c(C)c1C.Cc1c(F)c(C)c(F)c(F)c1F.Cc1c(F)c(F)c(C)c(F)c1F.Cc1cc(C)c(C)cc1C.Cc1cc(C)c(F)c(F)c1F.Cc1cc(C)c(F)cc1F.Cc1cc(F)c(C)c(F)c1F.Cc1cc(F)c(C)cc1F.Cc1cc(F)cc(C)c1F.Cc1cc(F)cc(C)n1.Cc1ccc(-c2ccc(C)cn2)nc1.Cc1ccc(-c2ccc(C)nc2)cn1.Cc1ccc(-c2ccc(C)nc2)nc1.Cc1ccc(C)c(F)c1.Cc1ccc(C)c(F)c1F.Cc1ccc(C)cc1.Cc1ccc(C)nc1.Cc1cccc(C)c1.Cc1cccc(C)c1F.Cc1cccc(C)n1
• InChI: InChI=1S/3C12H12N2.C12H18.C10H14.C9H12O.2C8H6F4.2C8H7F3.4C8H8F2.2C8H9F.2C8H10.C7H8FN.2C7H9N.34CH4/c1-9-3-6-12(14-7-9)11-5-4-10(2)13-8-11;1-9-3-5-11(7-13-9)12-6-4-10(2)14-8-12;1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12;1-7-8(2)10(4)12(6)11(5)9(7)3;1-7-5-9(3)10(4)6-8(7)2;1-7-4-5-8(2)9(6-7)10-3;1-3-5(9)7(11)4(2)8(12)6(3)10;1-3-5(9)4(2)7(11)8(12)6(3)10;1-4-3-6(9)5(2)8(11)7(4)10;1-4-3-5(2)7(10)8(11)6(4)9;1-5-3-8(10)6(2)4-7(5)9;1-5-3-7(9)4-6(2)8(5)10;1-5-3-6(2)8(10)4-7(5)9;1-5-3-4-6(2)8(10)7(5)9;1-6-3-4-7(2)8(9)5-6;1-6-4-3-5-7(2)8(6)9;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-5-3-7(8)4-6(2)9-5;1-6-3-4-7(2)8-5-6;1-6-4-3-5-7(2)8-6;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h3*3-8H,1-2H3;1-6H3;5-6H,1-4H3;4-6H,1-3H3;2*1-2H3;2*3H,1-2H3;4*3-4H,1-2H3;2*3-5H,1-2H3;2*3-6H,1-2H3;3-4H,1-2H3;2*3-5H,1-2H3;34*1H4
• InChIKey: SUJHGACLVHCIOT-UHFFFAOYSA-N
• XLogP: 74.89
• TPSA: 125.24 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 4
• Heavy Atoms: 253
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	3576.11
LogP ≤ 5	74.89
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene?

The IUPAC name of 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene (CID 160939909) is 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene.

What is the SMILES notation for 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene?

The canonical SMILES for 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.COc1cc(C)ccc1C.Cc1c(C)c(C)c(C)c(C)c1C.Cc1c(F)c(C)c(F)c(F)c1F.Cc1c(F)c(F)c(C)c(F)c1F.Cc1cc(C)c(C)cc1C.Cc1cc(C)c(F)c(F)c1F.Cc1cc(C)c(F)cc1F.Cc1cc(F)c(C)c(F)c1F.Cc1cc(F)c(C)cc1F.Cc1cc(F)cc(C)c1F.Cc1cc(F)cc(C)n1.Cc1ccc(-c2ccc(C)cn2)nc1.Cc1ccc(-c2ccc(C)nc2)cn1.Cc1ccc(-c2ccc(C)nc2)nc1.Cc1ccc(C)c(F)c1.Cc1ccc(C)c(F)c1F.Cc1ccc(C)cc1.Cc1ccc(C)nc1.Cc1cccc(C)c1.Cc1cccc(C)c1F.Cc1cccc(C)n1.

What is the InChIKey of 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene?

The InChIKey is SUJHGACLVHCIOT-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H12N2.C12H18.C10H14.C9H12O.2C8H6F4.2C8H7F3.4C8H8F2.2C8H9F.2C8H10.C7H8FN.2C7H9N.34CH4/c1-9-3-6-12(14-7-9)11-5-4-10(2)13-8-11;1-9-3-5-11(7-13-9)12-6-4-10(2)14-8-12;1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12;1-7-8(2)10(4)12(6)11(5)9(7)3;1-7-5-9(3)10(4)6-8(7)2;1-7-4-5-8(2)9(6-7)10-3;1-3-5(9)7(11)4(2)8(12)6(3)10;1-3-5(9)4(2)7(11)8(12)6(3)10;1-4-3-6(9)5(2)8(11)7(4)10;1-4-3-5(2)7(10)8(11)6(4)9;1-5-3-8(10)6(2)4-7(5)9;1-5-3-7(9)4-6(2)8(5)10;1-5-3-6(2)8(10)4-7(5)9;1-5-3-4-6(2)8(10)7(5)9;1-6-3-4-7(2)8(9)5-6;1-6-4-3-5-7(2)8(6)9;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-5-3-7(8)4-6(2)9-5;1-6-3-4-7(2)8-5-6;1-6-4-3-5-7(2)8-6;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h3*3-8H,1-2H3;1-6H3;5-6H,1-4H3;4-6H,1-3H3;2*1-2H3;2*3H,1-2H3;4*3-4H,1-2H3;2*3-5H,1-2H3;2*3-6H,1-2H3;3-4H,1-2H3;2*3-5H,1-2H3;34*1H4.

What are the key properties of 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene?

1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene has a molecular weight of 3576.11 g/mol, XLogP of 74.89, 4 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 1,4-difluoro-2,5-dimethylbenzene;1,5-difluoro-2,4-dimethylbenzene;2,3-difluoro-1,4-dimethylbenzene;2,5-difluoro-1,3-dimethylbenzene;2,5-dimethylpyridine;2,6-dimethylpyridine;2-fluoro-1,3-dimethylbenzene;2-fluoro-1,4-dimethylbenzene;4-fluoro-2,6-dimethylpyridine;1,2,3,4,5,6-hexamethylbenzene;methane;2-methoxy-1,4-dimethylbenzene;2-methyl-5-(5-methyl-2-pyridinyl)pyridine;2-methyl-5-(6-methyl-3-pyridinyl)pyridine;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;1,2,3,5-tetrafluoro-4,6-dimethylbenzene;1,2,4,5-tetrafluoro-3,6-dimethylbenzene;1,2,4,5-tetramethylbenzene;1,3,4-trifluoro-2,5-dimethylbenzene;2,3,4-trifluoro-1,5-dimethylbenzene;1,3-xylene;1,4-xylene is sourced from PubChem (CID 160939909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).