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Home Carbonyls 3-Amino-5-(ethoxycarbonyl)benzoic acid

3-Amino-5-(ethoxycarbonyl)benzoic acid

CAS No.:
1312425-07-2
Catalog Number:
AG00HSEA
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
96%
In Stock USA
United States
$244
- +
250mg
96%
In Stock USA
United States
$388
- +
1g
96%
In Stock USA
United States
$975
- +
5g
96%
In Stock USA
United States
$2838
- +
10g
96%
In Stock USA
United States
$4525
- +
Product Description
Catalog Number:
AG00HSEA
Chemical Name:
3-Amino-5-(ethoxycarbonyl)benzoic acid
CAS Number:
1312425-07-2
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
MDL Number:
MFCD23703013
IUPAC Name:
3-amino-5-ethoxycarbonylbenzoic acid
InChI:
InChI=1S/C10H11NO4/c1-2-15-10(14)7-3-6(9(12)13)4-8(11)5-7/h3-5H,2,11H2,1H3,(H,12,13)
InChI Key:
FWJOEEOPJUMDND-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(N)cc(c1)C(=O)O
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
89.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
Enrichment and properties of an anaerobic mixed culture that reductively deiodinates 5-amino-2,4,6-triiodoisophthalic acid, an X-ray contrast agent precursor. Applied microbiology and biotechnology 20031001
Properties