Methyl 4-(Acetoxymethyl)benzoate - CAS 27548-25-0
Catalog: |
BB019605 |
Product Name: |
Methyl 4-(Acetoxymethyl)benzoate |
CAS: |
27548-25-0 |
Synonyms: |
4-(acetyloxymethyl)benzoic acid methyl ester; methyl 4-(acetyloxymethyl)benzoate |
IUPAC Name: | methyl 4-(acetyloxymethyl)benzoate |
Description: | Methyl 4-(Acetoxymethyl)benzoate (CAS# 27548-25-0 ) is a useful research chemical. |
Molecular Weight: | 208.21 |
Molecular Formula: | C11H12O4 |
Canonical SMILES: | CC(=O)OCC1=CC=C(C=C1)C(=O)OC |
InChI: | InChI=1S/C11H12O4/c1-8(12)15-7-9-3-5-10(6-4-9)11(13)14-2/h3-6H,7H2,1-2H3 |
InChI Key: | HQTKRZQPZMGMAP-UHFFFAOYSA-N |
LogP: | 1.53630 |
Publication Number | Title | Priority Date |
US-2007213283-A1 | Macrolides substituted at the 4"-position | 20030513 |
US-2004142876-A1 | Peptides and their use as inhibitors of hepatitis c virus ns3 protease | 20010329 |
US-7119073-B2 | Peptides and their use as inhibitors of hepatitis C virus ns3 protease | 20010329 |
JP-2001172210-A | Method for producing alcohol compound | 19991215 |
EP-1084137-B1 | Peptide inhibitors of hepatitis c virus ns3 protease | 19980610 |
PMID | Publication Date | Title | Journal |
18225893 | 20080317 | Factors affecting the selectivity of the oxidation of methyl p-toluate by cobalt(III) | Inorganic chemistry |
Complexity: | 229 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.07355886 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.07355886 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 52.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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