5,6-dichloro-1,2-dimethylbenzimidazole

C9H8Cl2N2 — CID 840715

IUPAC5,6-dichloro-1,2-dimethylbenzimidazole
SMILESCc1nc2cc(Cl)c(Cl)cc2n1C
InChIInChI=1S/C9H8Cl2N2/c1-5-12-8-3-6(10)7(11)4-9(8)13(5)2/h3-4H,1-2H3
InChIKeyZLJHHGSEAITOGJ-UHFFFAOYSA-N
MW215.08 g/mol
LogP3.19
Rot. Bonds

About 5,6-dichloro-1,2-dimethylbenzimidazole

5,6-dichloro-1,2-dimethylbenzimidazole (PubChem CID 840715) has the molecular formula C9H8Cl2N2 and a molecular weight of 215.08 g/mol. Its IUPAC name is 5,6-dichloro-1,2-dimethylbenzimidazole.

Molecular Properties

Compound Name5,6-dichloro-1,2-dimethylbenzimidazole
PubChem CID840715
Molecular FormulaC9H8Cl2N2
Molecular Weight215.08 g/mol
Exact Mass214.01
IUPAC Name5,6-dichloro-1,2-dimethylbenzimidazole
SMILESCc1nc2cc(Cl)c(Cl)cc2n1C
InChIInChI=1S/C9H8Cl2N2/c1-5-12-8-3-6(10)7(11)4-9(8)13(5)2/h3-4H,1-2H3
InChIKeyZLJHHGSEAITOGJ-UHFFFAOYSA-N
XLogP3.19
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.08
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Chlormidazole
CID 71821
5-Chloro-2-methylbenzimidazole
CID 76063
5,6-Dichloro-1H-benzimidazole
CID 331775
Chlorflurazole
CID 19232
5,6-Dichloro-2-(trifluoromethyl)-1H-benzimidazole
CID 16859
5,6-Dichloro-2-methylbenzimidazole
CID 608319
5,6-dichloro-1-methyl-1H-1,3-benzodiazol-2-amine
CID 612073
1,2-Dimethylbenzimidazole
CID 312693
1H-Benzimidazolium, 1,2,3-trimethyl-, iodide (1:1)
CID 199168
Benzimidazole, 5,6-dichloro-2-pentafluoroethyl-
CID 59446
1-Ethyl-2-methylbenzimidazole
CID 22054
5-chloro-1-methyl-1H-1,3-benzodiazol-2-amine
CID 113622

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-1,2-dimethylbenzimidazole?
The IUPAC name of 5,6-dichloro-1,2-dimethylbenzimidazole (CID 840715) is 5,6-dichloro-1,2-dimethylbenzimidazole.
What is the SMILES notation for 5,6-dichloro-1,2-dimethylbenzimidazole?
The canonical SMILES for 5,6-dichloro-1,2-dimethylbenzimidazole is Cc1nc2cc(Cl)c(Cl)cc2n1C.
What is the InChIKey of 5,6-dichloro-1,2-dimethylbenzimidazole?
The InChIKey is ZLJHHGSEAITOGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8Cl2N2/c1-5-12-8-3-6(10)7(11)4-9(8)13(5)2/h3-4H,1-2H3.
What are the key properties of 5,6-dichloro-1,2-dimethylbenzimidazole?
5,6-dichloro-1,2-dimethylbenzimidazole has a molecular weight of 215.08 g/mol, XLogP of 3.19, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-1,2-dimethylbenzimidazole is sourced from PubChem (CID 840715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).