Methyl 3-Bromopyrrole-2-carboxylate - CAS 941714-57-4
Catalog: |
BB041217 |
Product Name: |
Methyl 3-Bromopyrrole-2-carboxylate |
CAS: |
941714-57-4 |
Synonyms: |
3-bromo-1H-pyrrole-2-carboxylic acid methyl ester; methyl 3-bromo-1H-pyrrole-2-carboxylate |
IUPAC Name: | methyl 3-bromo-1H-pyrrole-2-carboxylate |
Description: | Methyl 3-Bromopyrrole-2-carboxylate (CAS# 941714-57-4) is a useful research chemical. |
Molecular Weight: | 204.02 |
Molecular Formula: | C6H6BrNO2 |
Canonical SMILES: | COC(=O)C1=C(C=CN1)Br |
InChI: | InChI=1S/C6H6BrNO2/c1-10-6(9)5-4(7)2-3-8-5/h2-3,8H,1H3 |
InChI Key: | RWYUPXPKZMQREC-UHFFFAOYSA-N |
Appearance: | Solid |
MDL: | MFCD23106341 |
LogP: | 1.56380 |
Publication Number | Title | Priority Date |
CN-111393459-A | SHP2 inhibitor and application thereof | 20200416 |
WO-2021178420-A1 | Compounds targeting rna-binding proteins or rna-modifying proteins | 20200303 |
WO-2021099793-A1 | 1-aminosulfonyl-2-carboxypyrrole derivatives as metallo-beta-lactamase inhibitors | 20191120 |
WO-2021055326-A1 | Azole-fused pyridazin-3(2h)-one derivatives | 20190916 |
JP-2020193176-A | New biaryl derivatives and their pharmaceutical applications | 20190530 |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.95819 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.95819 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 42.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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