3-Benzofurancarboxylic acid, 5-methoxy-2-methyl-


Chemical Name: 3-Benzofurancarboxylic acid, 5-methoxy-2-methyl-
CAS Number: 29735-88-4
Product Number: AG002Z9I(AGN-PC-0JURFV)
Synonyms:
MDL No:
Molecular Formula: C11H10O4
Molecular Weight: 206.1947

Identification/Properties


Computed Properties
Molecular Weight:
206.197g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
206.058g/mol
Monoisotopic Mass:
206.058g/mol
Topological Polar Surface Area:
59.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
253
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H312-H332
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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