Home Aminos 2-Acetylaminoisonicotinic acid

2-Acetylaminoisonicotinic acid

CAS No.:
54221-95-3
Catalog Number:
AG00D9JM
Molecular Formula:
C8H8N2O3
Molecular Weight:
180.1607
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$25
- +
5g
97%
In Stock USA
United States
$100
- +
10g
97%
In Stock USA
United States
$188
- +
25g
97%
In Stock USA
United States
$400
- +
100g
97%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG00D9JM
Chemical Name:
2-Acetylaminoisonicotinic acid
CAS Number:
54221-95-3
Molecular Formula:
C8H8N2O3
Molecular Weight:
180.1607
MDL Number:
MFCD00233713
IUPAC Name:
2-acetamidopyridine-4-carboxylic acid
InChI:
InChI=1S/C8H8N2O3/c1-5(11)10-7-4-6(8(12)13)2-3-9-7/h2-4H,1H3,(H,12,13)(H,9,10,11)
InChI Key:
VNQIEKXUBYBTPS-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1nccc(c1)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:
-0.3  
Properties