Methyl 3-(2-Iodophenyl)-3-oxopropionate - CAS 676348-63-3
Catalog: |
BB033353 |
Product Name: |
Methyl 3-(2-Iodophenyl)-3-oxopropionate |
CAS: |
676348-63-3 |
Synonyms: |
3-(2-iodophenyl)-3-oxopropanoic acid methyl ester; methyl 3-(2-iodophenyl)-3-oxopropanoate |
IUPAC Name: | methyl 3-(2-iodophenyl)-3-oxopropanoate |
Description: | Methyl 3-(2-Iodophenyl)-3-oxopropionate (CAS# 676348-63-3 ) is a useful research chemical. |
Molecular Weight: | 304.08 |
Molecular Formula: | C10H9IO3 |
Canonical SMILES: | COC(=O)CC(=O)C1=CC=CC=C1I |
InChI: | InChI=1S/C10H9IO3/c1-14-10(13)6-9(12)7-4-2-3-5-8(7)11/h2-5H,6H2,1H3 |
InChI Key: | LGFREBKLHSCRQF-UHFFFAOYSA-N |
LogP: | 2.03700 |
Publication Number | Title | Priority Date |
DE-69910799-T2 | AS INHIBITORS OF AICAR USEFUL LINKS | 19980904 |
EP-1109560-A1 | Compounds useful as aicarft inhibitors | 19980904 |
EP-1109560-A4 | COMPOUNDS USEFUL AS AICARFT INHIBITORS | 19980904 |
EP-1109560-B1 | Compounds useful as aicarft inhibitors | 19980904 |
US-6525050-B1 | (4-oxo-2-pyrimidinyl)thioalkyl compounds useful as AICARFT inhibitors | 19980904 |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 303.95964 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 303.95964 |
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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