Home Other Building Blocks 2-(furan-2-amido)-4,5-dimethoxybenzoic acid

2-(furan-2-amido)-4,5-dimethoxybenzoic acid

CAS No.:
332163-04-9
Catalog Number:
AG019GGE
Molecular Formula:
C14H13NO6
Molecular Weight:
291.2561
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Product Description
Catalog Number:
AG019GGE
Chemical Name:
2-(furan-2-amido)-4,5-dimethoxybenzoic acid
CAS Number:
332163-04-9
Molecular Formula:
C14H13NO6
Molecular Weight:
291.2561
MDL Number:
MFCD01935266
IUPAC Name:
2-(furan-2-carbonylamino)-4,5-dimethoxybenzoic acid
InChI:
InChI=1S/C14H13NO6/c1-19-11-6-8(14(17)18)9(7-12(11)20-2)15-13(16)10-4-3-5-21-10/h3-7H,1-2H3,(H,15,16)(H,17,18)
InChI Key:
KZLNQJXZHDOUIA-UHFFFAOYSA-N
SMILES:
COc1cc(C(=O)O)c(cc1OC)NC(=O)c1ccco1
Properties
Complexity:
388  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.074g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
291.259g/mol
Monoisotopic Mass:
291.074g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties