Basic information
- Standard SMILES
CCOC(=O)c1cc2ccoc2[nH]1- InChIKey
RCPANSRSRKXEKX-UHFFFAOYSA-N- Molecular formula
- C9H9NO3
- Average molar mass
- 179.17 g/mol
Names & identifiers
- Preferred name
- ethyl 6H-furo[2,3-b]pyrrole-5-carboxylate
- IUPAC
- ethyl 6H-furo[2,3-b]pyrrole-5-carboxylate
- English name
- Ethyl 6H-furo[2,3-b]pyrrole-5-carboxylate
- Molecular formula
- C9H9NO3
- Molecular weight
- 179.17
Names & synonyms
ethyl 6H-furo[2,3-b]pyrrole-5-carboxylate58326-31-1SCHEMBL21307332MFCD06761693AKOS006293159AS-65206DB-091128CS-0453847A126656H-furo[3,2-d]pyrrole-5-carboxylic acid ethyl ester
Database identifiers
- CAS
58326-31-1
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 55.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 207
Physicochemical properties
- Boiling point
- 298.3 · 298.3±20.0 °C(Predicted)
- Density
- 1.288 · 1.288±0.06 g/cm3(Predicted)
- pka
- 13.95 · 13.95±0.30(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
苏州美石生物科技有限公司1173954148q · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [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.
Linked notes
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