2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole

C118H121ClF3N37O4 — CID 159105801

About 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole

2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole (PubChem CID 159105801) has the molecular formula C118H121ClF3N37O4 and a molecular weight of 2213.97 g/mol. Its IUPAC name is 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole.

Molecular Properties

• Compound Name: 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole
• PubChem CID: 159105801
• Molecular Formula: C118H121ClF3N37O4
• Molecular Weight: 2213.97 g/mol
• Exact Mass: 2212.00
• IUPAC Name: 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole
• SMILES: COc1cc(C)c(-n2nccn2)cc1OC.COc1ccc(-n2nccn2)c(C)c1.COc1ccc(-n2nccn2)c(C)c1F.Cc1c(F)cccc1-n1nccn1.Cc1cc(C#N)ccc1-n1nccn1.Cc1cc(Cl)ccc1-n1nccn1.Cc1cc(F)ccc1-n1nccn1.Cc1ccc(-n2nccn2)c(C)c1.Cc1ccc(-n2nccn2)c(C)c1C.Cc1ccc(C)c(-n2nccn2)c1.Cc1cccc(-n2nccn2)c1C.Cc1ccccc1-n1nccn1
• InChI: InChI=1S/C11H13N3O2.C11H13N3.C10H10FN3O.C10H8N4.C10H11N3O.3C10H11N3.C9H8ClN3.2C9H8FN3.C9H9N3/c1-8-6-10(15-2)11(16-3)7-9(8)14-12-4-5-13-14;1-8-4-5-11(10(3)9(8)2)14-12-6-7-13-14;1-7-8(14-12-5-6-13-14)3-4-9(15-2)10(7)11;1-8-6-9(7-11)2-3-10(8)14-12-4-5-13-14;1-8-7-9(14-2)3-4-10(8)13-11-5-6-12-13;1-8-3-4-10(9(2)7-8)13-11-5-6-12-13;1-8-3-4-9(2)10(7-8)13-11-5-6-12-13;1-8-4-3-5-10(9(8)2)13-11-6-7-12-13;2*1-7-6-8(10)2-3-9(7)13-11-4-5-12-13;1-7-8(10)3-2-4-9(7)13-11-5-6-12-13;1-8-4-2-3-5-9(8)12-10-6-7-11-12/h4-7H,1-3H3;4-7H,1-3H3;3-6H,1-2H3;2-6H,1H3;3-7H,1-2H3;3*3-7H,1-2H3;3*2-6H,1H3;2-7H,1H3
• InChIKey: KDWFEJIDFJHWDE-UHFFFAOYSA-N
• XLogP: 21.43
• TPSA: 429.23 Ų
• H-Bond Acceptors: 41
• Rotatable Bonds: 16
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2213.97
LogP ≤ 5	21.43
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	41

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole?

The IUPAC name of 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole (CID 159105801) is 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole.

What is the SMILES notation for 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole?

The canonical SMILES for 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole is COc1cc(C)c(-n2nccn2)cc1OC.COc1ccc(-n2nccn2)c(C)c1.COc1ccc(-n2nccn2)c(C)c1F.Cc1c(F)cccc1-n1nccn1.Cc1cc(C#N)ccc1-n1nccn1.Cc1cc(Cl)ccc1-n1nccn1.Cc1cc(F)ccc1-n1nccn1.Cc1ccc(-n2nccn2)c(C)c1.Cc1ccc(-n2nccn2)c(C)c1C.Cc1ccc(C)c(-n2nccn2)c1.Cc1cccc(-n2nccn2)c1C.Cc1ccccc1-n1nccn1.

What is the InChIKey of 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole?

The InChIKey is KDWFEJIDFJHWDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2.C11H13N3.C10H10FN3O.C10H8N4.C10H11N3O.3C10H11N3.C9H8ClN3.2C9H8FN3.C9H9N3/c1-8-6-10(15-2)11(16-3)7-9(8)14-12-4-5-13-14;1-8-4-5-11(10(3)9(8)2)14-12-6-7-13-14;1-7-8(14-12-5-6-13-14)3-4-9(15-2)10(7)11;1-8-6-9(7-11)2-3-10(8)14-12-4-5-13-14;1-8-7-9(14-2)3-4-10(8)13-11-5-6-12-13;1-8-3-4-10(9(2)7-8)13-11-5-6-12-13;1-8-3-4-9(2)10(7-8)13-11-5-6-12-13;1-8-4-3-5-10(9(8)2)13-11-6-7-12-13;2*1-7-6-8(10)2-3-9(7)13-11-4-5-12-13;1-7-8(10)3-2-4-9(7)13-11-5-6-12-13;1-8-4-2-3-5-9(8)12-10-6-7-11-12/h4-7H,1-3H3;4-7H,1-3H3;3-6H,1-2H3;2-6H,1H3;3-7H,1-2H3;3*3-7H,1-2H3;3*2-6H,1H3;2-7H,1H3.

What are the key properties of 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole?

2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole has a molecular weight of 2213.97 g/mol, XLogP of 21.43, 16 rotatable bonds, 0 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-chloro-2-methylphenyl)triazole;2-(4,5-dimethoxy-2-methylphenyl)triazole;2-(2,3-dimethylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;2-(2,5-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(3-fluoro-2-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;3-methyl-4-(triazol-2-yl)benzonitrile;2-(2,3,4-trimethylphenyl)triazole is sourced from PubChem (CID 159105801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).