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Home Other Building Blocks 2-Amino-4,5-dimethoxybenzoic acid

2-Amino-4,5-dimethoxybenzoic acid

CAS No.:
5653-40-7
Catalog Number:
AG003GEG
Molecular Formula:
C9H11NO4
Molecular Weight:
197.1879
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$32
- +
100g
98%
In Stock USA
United States
$100
- +
500g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG003GEG
Chemical Name:
2-Amino-4,5-dimethoxybenzoic acid
CAS Number:
5653-40-7
Molecular Formula:
C9H11NO4
Molecular Weight:
197.1879
MDL Number:
MFCD00011671
IUPAC Name:
2-amino-4,5-dimethoxybenzoic acid
InChI:
InChI=1S/C9H11NO4/c1-13-7-3-5(9(11)12)6(10)4-8(7)14-2/h3-4H,10H2,1-2H3,(H,11,12)
InChI Key:
HJVAVGOPTDJYOJ-UHFFFAOYSA-N
SMILES:
COc1cc(C(=O)O)c(cc1OC)N
EC Number:
227-095-3
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.069g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.19g/mol
Monoisotopic Mass:
197.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Novel acid mono azo dye compound: synthesis, characterization, vibrational, optical and theoretical investigations of 2-[(E)-(8-hydroxyquinolin-5-yl)-diazenyl]-4,5-dimethoxybenzoic acid. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20121101
Collision-induced fragmentation of negative ions from N-linked glycans derivatized with 2-aminobenzoic acid. Journal of mass spectrometry : JMS 20050501
First isolation and characterization of eight regioisomers for [60]fullerene-benzene bisadducts. Organic letters 20010419
Properties