Methyl 3-(2-Bromophenyl)-3-oxopropanoate - CAS 294881-08-6
Catalog: |
BB020216 |
Product Name: |
Methyl 3-(2-Bromophenyl)-3-oxopropanoate |
CAS: |
294881-08-6 |
Synonyms: |
3-(2-bromophenyl)-3-oxopropanoic acid methyl ester; methyl 3-(2-bromophenyl)-3-oxopropanoate |
IUPAC Name: | methyl 3-(2-bromophenyl)-3-oxopropanoate |
Description: | Methyl 3-(2-Bromophenyl)-3-oxopropanoate (CAS# 294881-08-6 ) is a useful research chemical. |
Molecular Weight: | 257.08 |
Molecular Formula: | C10H9BrO3 |
Canonical SMILES: | COC(=O)CC(=O)C1=CC=CC=C1Br |
InChI: | InChI=1S/C10H9BrO3/c1-14-10(13)6-9(12)7-4-2-3-5-8(7)11/h2-5H,6H2,1H3 |
InChI Key: | QMLPQBSYXCTIEC-UHFFFAOYSA-N |
LogP: | 2.19490 |
Publication Number | Title | Priority Date |
JP-2000264888-A | Bicyclic pyrimidine derivatives, intermediates for their production, methods for their production, and herbicides containing them as active ingredients | 19990111 |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 255.97351 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 255.97351 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 43.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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