Home Other Building Blocks 3-methoxy-4-{[(2-methoxyphenyl)carbamoyl]methoxy}benzoic acid

3-methoxy-4-{[(2-methoxyphenyl)carbamoyl]methoxy}benzoic acid

CAS No.:
522624-52-8
Catalog Number:
AG019GHG
Molecular Formula:
C17H17NO6
Molecular Weight:
331.3200
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Product Description
Catalog Number:
AG019GHG
Chemical Name:
3-methoxy-4-{[(2-methoxyphenyl)carbamoyl]methoxy}benzoic acid
CAS Number:
522624-52-8
Molecular Formula:
C17H17NO6
Molecular Weight:
331.3200
MDL Number:
MFCD03651688
IUPAC Name:
3-methoxy-4-[2-(2-methoxyanilino)-2-oxoethoxy]benzoic acid
InChI:
InChI=1S/C17H17NO6/c1-22-13-6-4-3-5-12(13)18-16(19)10-24-14-8-7-11(17(20)21)9-15(14)23-2/h3-9H,10H2,1-2H3,(H,18,19)(H,20,21)
InChI Key:
RVIVKAMHLZUMQX-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OCC(=O)Nc1ccccc1OC)C(=O)O
Properties
Complexity:
429  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.106g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
331.324g/mol
Monoisotopic Mass:
331.106g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
94.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties