Basic information
- CAS
6868-37-7- Standard SMILES
N#Cc1nc2ccccc2[nH]1- InChIKey
VEKMJKMSTPFHQD-UHFFFAOYSA-N- Molecular formula
- C8H5N3
- Average molar mass
- 143.15 g/mol
- Monoisotopic mass
- 143.04834716
Names & identifiers
- Preferred name
- 1H-benzimidazole-2-carbonitrile
- IUPAC
- 1H-benzimidazole-2-carbonitrile
- English name
- 2-Benzimidazolcarbonitrile
- Molecular formula
- C8H5N3
- Molecular weight
- 143.15
Names & synonyms
1H-benzimidazole-2-carbonitrile6868-37-7DTXSID70357114RefChem:237585DTXCID403081731H-Benzo[d]imidazole-2-carbonitrile2-BENZIMIDAZOLCARBONITRILE2-cyanobenzimidazoleMFCD00493627benzimidazole-2-carbonitrile1H-1,3-benzodiazole-2-carbonitrile2-Benzimidazolecarbonitrile
Show more names
1H-Benzoimidazole-2-carbonitrile1H-Benzimidazole-2-carbonitrile(9CI)1H-benzimidazole-2-carbonitrile(SALTDATA: FREE)
SCHEMBL244929CHEMBL4860178SCHEMBL11467414SCHEMBL15421643SCHEMBL31677104VEKMJKMSTPFHQD-UHFFFAOYSA-NHMS1682P06ALBB-026096
Database identifiers
- CAS
6868-37-7- PubChem CID
- 843858
- DTXSID
DTXSID70357114- ChEMBL
CHEMBL4860178- Nikkaji
- J783.267B
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 52.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers16 total
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
上海威尔舒氪医药科技有限公司15250615384
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海策嵘生物科技有限公司（定制合成实验室）13062833949 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
上海银林医药科技有限公司15000379094 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
16 records
Compound notes
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