2-Benzofurancarboxylic acid, 6-methoxy-, methyl ester


Chemical Name: 2-Benzofurancarboxylic acid, 6-methoxy-, methyl ester
CAS Number: 55364-67-5
Product Number: AG003RYN(AGN-PC-0KNWIB)
Synonyms:
MDL No: MFCD11975070
Molecular Formula: C11H10O4
Molecular Weight: 206.1947

Identification/Properties


Properties
MP:
94.2-95.2℃(Solv: water (7732-18-5); methanol (67-56-1))
BP:
301.4°C at 760 mmHg
Form:
Solid
Computed Properties
Molecular Weight:
206.197g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
206.058g/mol
Monoisotopic Mass:
206.058g/mol
Topological Polar Surface Area:
48.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
241
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#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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