Methyl 5-Methoxy-2,3-dihydrobenzofuran-3-acetate - CAS 93772-89-5
Catalog: |
BB041077 |
Product Name: |
Methyl 5-Methoxy-2,3-dihydrobenzofuran-3-acetate |
CAS: |
93772-89-5 |
Synonyms: |
2-(5-methoxy-2,3-dihydrobenzofuran-3-yl)acetic acid methyl ester; methyl 2-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)acetate |
IUPAC Name: | methyl 2-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)acetate |
Description: | Methyl 5-Methoxy-2,3-dihydrobenzofuran-3-acetate (CAS# 93772-89-5 ) is a useful research chemical. |
Molecular Weight: | 222.24 |
Molecular Formula: | C12H14O4 |
Canonical SMILES: | COC1=CC2=C(C=C1)OCC2CC(=O)OC |
InChI: | InChI=1S/C12H14O4/c1-14-9-3-4-11-10(6-9)8(7-16-11)5-12(13)15-2/h3-4,6,8H,5,7H2,1-2H3 |
InChI Key: | UEYJPVIIMYMORG-UHFFFAOYSA-N |
LogP: | 1.73430 |
Publication Number | Title | Priority Date |
EP-0281261-A2 | 3-Aminomethyl derivatives of indane, indoline and dihydrobenzofurane and dihydrobenzothiophene | 19870226 |
EP-0281261-B1 | 3-aminomethyl derivatives of indane, indoline and dihydrobenzofurane and dihydrobenzothiophene | 19870226 |
US-4847254-A | CNS affecting 5-oxy-3-aminomethyl-dihydro-benzofurans and benzothiophenes | 19870226 |
US-4946863-A | CNS-affecting 6-oxy-3-aminomethyl indanes, compositions thereof, and method of treating therewith | 19870226 |
Complexity: | 253 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 222.08920892 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.08920892 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 44.8 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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