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90996-89-7

90996-89-7 | 1,3-Benzodioxol-5-ol, 6-(2-benzofuranyl)-7-methoxy-

CAS No: 90996-89-7 Catalog No: AG006FRN MDL No:

Product Description

Catalog Number:
AG006FRN
Chemical Name:
1,3-Benzodioxol-5-ol, 6-(2-benzofuranyl)-7-methoxy-
CAS Number:
90996-89-7
Molecular Formula:
C16H12O5
Molecular Weight:
284.2635
IUPAC Name:
6-(1-benzofuran-2-yl)-7-methoxy-1,3-benzodioxol-5-ol
InChI:
InChI=1S/C16H12O5/c1-18-16-14(10(17)7-13-15(16)20-8-19-13)12-6-9-4-2-3-5-11(9)21-12/h2-7,17H,8H2,1H3
InChI Key:
ACHFSGOIKJNVJV-UHFFFAOYSA-N
SMILES:
COc1c(c(O)cc2c1OCO2)c1cc2c(o1)cccc2

Properties

Complexity:
376  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.068g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.267g/mol
Monoisotopic Mass:
284.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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