Basic information
- CAS
6232-91-3- Standard SMILES
COc1ccc2nc(N)[nH]c2c1- InChIKey
FXFSGALQLLEBJD-UHFFFAOYSA-N- Molecular formula
- C8H9N3O
- Average molar mass
- 163.18 g/mol
- Monoisotopic mass
- 163.07456192
Names & identifiers
- Preferred name
- 5-Methoxy-2-aminobenzimidazole
- IUPAC
- 6-methoxy-1H-benzimidazol-2-amine
- English name
- 5-METHOXY-1H-BENZOIMIDAZOL-2-YLAMINE
- Molecular formula
- C8H9N3O
- Molecular weight
- 163.18
Names & synonyms
6232-91-35-Methoxy-2-aminobenzimidazoleCCRIS 43575-METHOXY-1H-1,3-BENZODIAZOL-2-AMINEDTXSID90211385RefChem:536642DTXCID90133876878-534-65-Methoxy-1H-benzimidazole-2-ylamine5-METHOXY-1H-BENZOIMIDAZOL-2-YLAMINE6-methoxy-1H-benzimidazol-2-amine5-methoxy-1h-benzimidazol-2-amine
Show more names
5-METHOXY-1H-BENZIMIDAZOLE-2-AMINE
5-METHOXY-1H-BENZO[D]IMIDAZOL-2-AMINE2-AMINO-5-METHOXYBENZIMIDAZOLEMFCD027520505-Methoxy-1H-benzimidazol-2-amine; 5-Methoxy-2-aminobenzimidazole; 5-Methoxybenzimidazole-2-amine; 6-Methoxy-1H-benzimidazol-2-amine1H-Benzimidazol-2-amine,6-methoxy-1H-Benzimidazol-2-amine, 6-methoxy-1H-BENZIMIDAZOL-2-AMINE, 5-METHOXY-E86FT9YPC8
Database identifiers
- CAS
6232-91-3- PubChem CID
- 80384
- DTXSID
DTXSID90211385- UNII
- E86FT9YPC8
- EC Number
- 878-534-6
- Nikkaji
- J484.323A
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 164
Experimental & physicochemical properties
LogP0.57
Physicochemical properties
- Boiling point
- 400.6 · 400.6±37.0 °C(Predicted)
- Density
- 1.344 · 1.344±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- DMSO (Slightly), Methanol (Slightly)
- pka
- 10.33 · 10.33±0.10(Predicted)
- form
- Solid
- color
- Brown to Dark Brown
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H302-H335-H315
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H302-H335-H315
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Applications
UsesHeterocyclic amine with possible mutagenic properties.
Upstream & downstream products
Upstream raw materials
Suppliers62 total
宁波振岳医药科技有限公司19817745290 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Shaanxi Cuikang Pharmaceutical Technology Co., Ltd+86-13119157289 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
Aladdin Scientific[email protected]
南京玛奇朵医药科技有限公司19556085883 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
济南千叶医药技术有限公司0531-81313138 13066006660 · [email protected]
上海渤腾医药科技有限公司13524892556 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
上海堃睿化工科技有限公司+86-021-50935922
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
西安乐纯化工有限责任公司029-15596886083 15596886083 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
盐城康迪森医药科技有限公司13812573443;18052965989 · [email protected]
上海百韧生物科技有限公司13564638271 · [email protected]
上海天习化工有限公司021-20960837,QQ1332204249 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海瀚思化工有限公司18916268197 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
安徽凯泽合联医药科技有限公司18130062233 · [email protected]
嘉兴市德亿化工有限公司86-0573-85866609 18367600069 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 400821072 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
聿锦（天津）科技有限公司13370351217 kungfu1217@1 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
西安瑞芬达生物技术有限公司19929974101 //1144079830; 19929974101 · [email protected]
重庆志圣科技有限公司023-67586781 17783613370 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
陕西萃康医药科技有限公司13186333400 19299362551 · [email protected]
Wuhan Topule Biopharmaceutical Co., Ltd+86-18327326525 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
宁波振岳医药科技有限公司0086-19817745290; 19817745290 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
Related reactions
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No reaction records under the current filter.
Compound notes
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