1-Benzyl-3-bromopyrrole-2,5-dione - CAS 112749-49-2
Catalog: |
BB003039 |
Product Name: |
1-Benzyl-3-bromopyrrole-2,5-dione |
CAS: |
112749-49-2 |
Synonyms: |
3-bromo-1-(phenylmethyl)pyrrole-2,5-dione; 1-benzyl-3-bromopyrrole-2,5-dione |
IUPAC Name: | 1-benzyl-3-bromopyrrole-2,5-dione |
Description: | 1-Benzyl-3-bromopyrrole-2,5-dione (CAS# 112749-49-2 ) is a useful research chemical. |
Molecular Weight: | 266.09 |
Molecular Formula: | C11H8BrNO2 |
Canonical SMILES: | C1=CC=C(C=C1)CN2C(=O)C=C(C2=O)Br |
InChI: | InChI=1S/C11H8BrNO2/c12-9-6-10(14)13(11(9)15)7-8-4-2-1-3-5-8/h1-6H,7H2 |
InChI Key: | LLBVECSKMXUDOT-UHFFFAOYSA-N |
LogP: | 1.77210 |
Publication Number | Title | Priority Date |
CN-112795943-A | Electrochemical synthesis method of 3, 4-dibromomaleimide | 20201231 |
CN-113149968-A | Compound serving as ketohexokinase inhibitor and application thereof | 20200430 |
CN-106243009-B | A kind of preparation method of the bromo- N-phenylmaleimides of 3- n-butylamine-baseds -4- | 20160802 |
CN-105949106-A | Preparation method of 3-amino-N-substituted maleimide compound | 20160629 |
CN-105949106-B | A kind of preparation method of the maleimide compound of 3- amino-N- substitutions | 20160629 |
Complexity: | 319 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 264.97384 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 264.97384 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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