Cas no 1207725-95-8 (6-cyano-1H-Benzimidazole-2-carboxylic acid)
1207725-95-8 structure
Product Name:6-cyano-1H-Benzimidazole-2-carboxylic acid
CAS No:1207725-95-8
MF:C9H5N3O2
MW:187.154901266098
CID:1101838
PubChem ID:46227817
Update Time:2025-10-05
6-cyano-1H-Benzimidazole-2-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 6-cyano-1H-Benzimidazole-2-carboxylic acid
- MFCD20692815
- SCHEMBL15625904
- 1207725-95-8
- BDBM50305664
- 5-Cyanobenzimidazole-2-carboxylic Acid
- DB-207707
- 5-CYANO-1H-1,3-BENZODIAZOLE-2-CARBOXYLIC ACID
- 5-cyano-1H-benzo[d]imidazole-2-carboxylic acid
- SY351945
- SCHEMBL20305429
- CHEMBL595948
-
- Inchi： 1S/C9H5N3O2/c10-4-5-1-2-6-7(3-5)12-8(11-6)9(13)14/h1-3H,(H,11,12)(H,13,14)
- InChI Key： BVHHTDXFMXBIJX-UHFFFAOYSA-N
- SMILES： OC(C1=NC2C=CC(C#N)=CC=2N1)=O
Computed Properties
- Exact Mass: 187.038176411g/mol
- Monoisotopic Mass: 187.038176411g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 296
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.3
- Topological Polar Surface Area: 89.8?2
6-cyano-1H-Benzimidazole-2-carboxylic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A061001243-1g |
5-Cyano-1H-benzimidazole-2-carboxylic acid |
1207725-95-8 | 98% | 1g |
$1340.00 | 2023-09-04 |
6-cyano-1H-Benzimidazole-2-carboxylic acid Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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