Basic information
- CAS
164648-60-6- Standard SMILES
Cl.NCc1ccc2[nH]cnc2c1- InChIKey
RKFITBVNDVXCSN-UHFFFAOYSA-N- Molecular formula
- C8H10ClN3
- Average molar mass
- 183.64 g/mol
- Monoisotopic mass
- 183.056325
Names & identifiers
- Preferred name
- (1H-Benzo[d]imidazol-5-yl)methanamine hydrochloride
- IUPAC
- 3H-benzimidazol-5-ylmethanamine;hydrochloride
- English name
- 1H-Benzimidazole-5-methanamine(9CI)
- Molecular formula
- C8H9N3
- Molecular weight
- 147.18
Names & synonyms
(1H-Benzo[d]imidazol-5-yl)methanamine hydrochloride1H-BENZIMIDAZOL-5-YLMETHYLAMINE HYDROCHLORIDE779353-78-51-(1H-1,3-BENZODIAZOL-5-YL)METHANAMINE HYDROCHLORIDE(1h-Benzo[d]imidazol-6-yl)methanamine hydrochloride3H-benzimidazol-5-ylmethanamine;hydrochlorideSCHEMBL3632899SCHEMBL32671448DTXSID10469104RKFITBVNDVXCSN-UHFFFAOYSA-NAKOS015849573CS-0270678
Show more names
(1H-benzo[d]iMidazol-5-yl)MethanaMinebenziMidazol-5-ylMethylaMine1H-Benzimidazole-5-methanamine1H-BENZIMIDAZOLE-6-METHANAMINE1H-benzimidazole-5-methylamine3H-benzimidazol-5-ylmethanamine1H-Benzimidazole-5-methanamine(9CI)C-(3H-Benzoimidazol-5-yl)-methylamine(1H-benzo[d]imidazol-6-yl)methanamine(1H-benzimidazol-5-ylmethyl)amine dihydrochloride
EN300-246544H54254(1H-1,3-benzodiazol-5-yl)methanamine hydrochloride(1H-Benzo[d]imidazol-5-yl)methanaminehydrochloride1-(1H-1,3-Benzimidazol-6-yl)methanamine--hydrogen chloride (1/1)
Properties
Computed structural properties
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 137
Physicochemical properties
- Boiling point
- 432.8 · 432.8±20.0 °C(Predicted)
- Density
- 1.278 · 1.278±0.06 g/cm3(Predicted)
- pka
- 12.79 · 12.79±0.10(Predicted)
Chemistry & industry
Suppliers21 total
陕西科贝莱药物研发有限公司13119135307 · [email protected]
Shaanxi Cuikang Pharmaceutical Technology Co., Ltd+86-13119157289 · [email protected]
上海爱孜康医药研究有限公司18721109360 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
菏泽星达医药科技有限公司13583079096 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
江阴康源生物医药科技有限公司0510-86010668 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
河北唯特医药科技有限公司
Related reactions
2 records
Compound notes
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