Basic information
- CAS
1083181-25-2- Standard SMILES
Brc1cc2cccnc2[nH]1- InChIKey
HKRBNTYNEXFATM-UHFFFAOYSA-N- Molecular formula
- C7H5BrN2
- Average molar mass
- 197.03 g/mol
- Monoisotopic mass
- 195.96361
Names & identifiers
- Preferred name
- 2-bromo-1H-pyrrolo[2,3-b]pyridine
- IUPAC
- 2-bromo-1H-pyrrolo[2,3-b]pyridine
- English name
- 2-bromo-1H-pyrrolo[2,3-b]pyridine
- Molecular formula
- C7H5BrN2
- Molecular weight
- 197.03
Names & synonyms
2-bromo-1H-pyrrolo[2,3-b]pyridine1083181-25-2MFCD115590182-bromo-7-azaindoleSCHEMBL2595303DTXSID20621357CS-B0559AKOS006315428AS-61273SY1119122-bromo-1H-pyrrolo [2,3-b] pyridine1H-Pyrrolo[2,3-b]pyridine, 2-bromo-
Show more names
FT-0652993A801846SCHEMBL28326897DB-059743F233556
Database identifiers
- CAS
1083181-25-2- PubChem CID
- 21998697
- DTXSID
DTXSID20621357
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 129
Physicochemical properties
- Density
- 1.77 · 1.770±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 12.22 · 12.22±0.40(Predicted)
- Appearance
- Off-white to yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
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
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers55 total
宁波振岳医药科技有限公司19817745290 · [email protected]
上海策嵘生物科技有限公司[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
安特希（苏州）生物科技有限公司19951207836 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
ChemeGen 中国18818260767 · [email protected]
苏州启航生物科技有限公司18151111370
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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