Basic information
- CAS
24786-52-5- Standard SMILES
Cn1c(=O)n(C)c2cc(Br)c(N)cc21- InChIKey
SXPRALARBJCCIH-UHFFFAOYSA-N- Molecular formula
- C9H10BrN3O
- Average molar mass
- 256.1 g/mol
- Monoisotopic mass
- 255.00072
Names & identifiers
- Preferred name
- 5-Amino-6-bromo-1,3-dimethyl-1H-benzo[d]imidazol-2(3H)-one
- IUPAC
- 5-amino-6-bromo-1,3-dimethylbenzimidazol-2-one
- English name
- 5-amino-6-bromo-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one(SALTDATA: FREE)
- Molecular formula
- C9H10BrN3O
- Molecular weight
- 256.1
Names & synonyms
24786-52-55-Amino-6-bromo-1,3-dimethyl-1H-benzo[d]imidazol-2(3H)-one5-amino-6-bromo-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one5-Amino-6-bromo-1,3-dimethyl-1,3-dihydro-benzoimidazol-2-oneMFCD066185845-amino-6-bromo-1,3-dimethylbenzimidazol-2-one2H-Benzimidazol-2-one, 5-amino-6-bromo-1,3-dihydro-1,3-dimethyl-5-Amino-6-bromo-1,3-dimethylbenzimidazol-2(3H)-one5-amino-6-bromo-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one(SALTDATA: FREE)SCHEMBL17534190DTXSID30406399SXPRALARBJCCIH-UHFFFAOYSA-N
Show more names
5-Amino-6-bromo-1,3-dihydro-1,3-dimethyl-2H-benzimidazol-2-one5-amino-6-bromo-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazol-2-one5-amino-6-bromo-1,3-dimethyl-1,3-dihydro-2H-benzo[d]imidazol-2-one
HMS1604P19SBB028122STK744101AKOS000113818CS-15919SY063103ST4124095CS-0067123
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 49.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 260
Physicochemical properties
- Boiling point
- 384.6 · 384.6±35.0 °C(Predicted)
- Density
- 1.645 · 1.645±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 3.81 · 3.81±0.20(Predicted)
- Appearance
- Off-white to light brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers21 total
韶远科技(上海)有限公司4000665055 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
济南千叶医药技术有限公司0531-81313138 13066006660 · [email protected]
连云港腾发生物科技有限公司0518-85475186 18705131893 · [email protected]
湖州清硫硅生物科技有限公司13626726938 · [email protected]
济南千叶医药技术有限公司70803088888 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
湖州澄博生物科技有限公司13626726938
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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