Methyl 2-(2-Formylphenyl)acetate - CAS 63969-83-5
Catalog: |
BB032336 |
Product Name: |
Methyl 2-(2-Formylphenyl)acetate |
CAS: |
63969-83-5 |
Synonyms: |
2-(2-formylphenyl)acetic acid methyl ester; methyl 2-(2-formylphenyl)acetate |
IUPAC Name: | methyl 2-(2-formylphenyl)acetate |
Description: | Methyl 2-(2-Formylphenyl)acetate (CAS# 63969-83-5) is a useful research chemical. |
Molecular Weight: | 178.18 |
Molecular Formula: | C10H10O3 |
Canonical SMILES: | COC(=O)CC1=CC=CC=C1C=O |
InChI: | InChI=1S/C10H10O3/c1-13-10(12)6-8-4-2-3-5-9(8)7-11/h2-5,7H,6H2,1H3 |
InChI Key: | HGYCMAAUZWDACG-UHFFFAOYSA-N |
Boiling Point: | 273.9 ℃ at 760 mmHg |
Density: | 1.157 g/cm3 |
MDL: | MFCD12755820 |
LogP: | 1.21460 |
Publication Number | Title | Priority Date |
WO-2020214537-A1 | Modulators of ras gtpase | 20190415 |
US-2019345135-A1 | Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors | 20180406 |
WO-2019195720-A1 | Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors | 20180406 |
AU-2019247471-A1 | Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors | 20180406 |
EP-3687506-A1 | Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors | 20180406 |
Complexity: | 189 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 178.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.062994177 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 43.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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