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839719-18-5

839719-18-5 | Acetic acid, [(5-acetyl-4-methoxy-6-benzofuranyl)oxy]-, ethyl ester

CAS No: 839719-18-5 Catalog No: AG004QJ0 MDL No:

Product Description

Catalog Number:
AG004QJ0
Chemical Name:
Acetic acid, [(5-acetyl-4-methoxy-6-benzofuranyl)oxy]-, ethyl ester
CAS Number:
839719-18-5
Molecular Formula:
C15H16O6
Molecular Weight:
292.2839
IUPAC Name:
ethyl 2-[(5-acetyl-4-methoxy-1-benzofuran-6-yl)oxy]acetate
InChI:
InChI=1S/C15H16O6/c1-4-19-13(17)8-21-12-7-11-10(5-6-20-11)15(18-3)14(12)9(2)16/h5-7H,4,8H2,1-3H3
InChI Key:
YFUVXBMHEMIKDQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1cc2occc2c(c1C(=O)C)OC

Properties

Complexity:
382  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.095g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.287g/mol
Monoisotopic Mass:
292.095g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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