Methyl-2-methyl-5-methylsulfonyl-4-(1-pyrrolyl)benzoate - CAS 176644-45-4
Catalog: |
BB013236 |
Product Name: |
Methyl-2-methyl-5-methylsulfonyl-4-(1-pyrrolyl)benzoate |
CAS: |
176644-45-4 |
Synonyms: |
0 |
IUPAC Name: | methyl 2-methyl-5-methylsulfonyl-4-pyrrol-1-ylbenzoate |
Description: | Methyl-2-methyl-5-methylsulfonyl-4-(1-pyrrolyl)benzoate (CAS# 176644-45-4 ) is a useful research chemical. |
Molecular Weight: | 293.34 |
Molecular Formula: | 0 |
Canonical SMILES: | 0 |
InChI: | 0 |
InChI Key: | 0 |
LogP: | 1.94190 |
Publication Number | Title | Priority Date |
CZ-2001176-A3 | Process for preparing benzoic acid derivative alkylated in position ortho | 19990706 |
DE-19929857-A1 | Process for the preparation of a 4- (pyrrol-1-yl) benzoylguanidine derivative | 19990629 |
WO-0102353-A1 | Method for producing a 4-(pyrrole-1-yl)-benzoylguanidine derivative | 19990629 |
AU-756673-B2 | Method for producing ortho-alkylated benzoic acid derivatives | 19980723 |
CA-2338300-A1 | Process for the preparation of ortho-alkylated benzoic acid derivatives | 19980723 |
Complexity: | 450 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 293.07217913 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 293.07217913 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 73.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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