Home Other Building Blocks 6-Acetamidonicotinic acid

6-Acetamidonicotinic acid

CAS No.:
21550-48-1
Catalog Number:
AG0038W2
Molecular Formula:
C8H8N2O3
Molecular Weight:
180.1607
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$50
- +
5g
96%
In Stock USA
United States
$238
- +
10g
96%
In Stock USA
United States
$438
- +
25g
96%
In Stock USA
United States
$875
- +
100g
96%
In Stock USA
United States
$2250
- +
Product Description
Catalog Number:
AG0038W2
Chemical Name:
6-Acetamidonicotinic acid
CAS Number:
21550-48-1
Molecular Formula:
C8H8N2O3
Molecular Weight:
180.1607
MDL Number:
MFCD11046979
IUPAC Name:
6-acetamidopyridine-3-carboxylic acid
InChI:
InChI=1S/C8H8N2O3/c1-5(11)10-7-3-2-6(4-9-7)8(12)13/h2-4H,1H3,(H,12,13)(H,9,10,11)
InChI Key:
RXSLHYTZMIUANX-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cn1)C(=O)O
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.053g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
180.163g/mol
Monoisotopic Mass:
180.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties