sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 2-Aminonicotinic acid

2-Aminonicotinic acid

CAS No.:
5345-47-1
Catalog Number:
AG00334F
Molecular Formula:
C6H6N2O2
Molecular Weight:
138.1240
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
97%
In Stock USA
United States
$13
- +
25g
97%
In Stock USA
United States
$23
- +
100g
97%
In Stock USA
United States
$63
- +
500g
97%
In Stock USA
United States
$294
- +
Product Description
Catalog Number:
AG00334F
Chemical Name:
2-Aminonicotinic acid
CAS Number:
5345-47-1
Molecular Formula:
C6H6N2O2
Molecular Weight:
138.1240
MDL Number:
MFCD00006318
IUPAC Name:
2-aminopyridine-3-carboxylic acid
InChI:
InChI=1S/C6H6N2O2/c7-5-4(6(9)10)2-1-3-8-5/h1-3H,(H2,7,8)(H,9,10)
InChI Key:
KPIVDNYJNOPGBE-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccnc1N
EC Number:
226-296-3
NSC Number:
3049
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.043g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
138.126g/mol
Monoisotopic Mass:
138.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Molecular structure (monomeric and dimeric structure) and HOMO-LUMO analysis of 2-aminonicotinic acid: a comparison of calculated spectroscopic properties with FT-IR and UV-vis. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120601
2-Amino-3-carb-oxy-pyridinium chloride hemihydrate. Acta crystallographica. Section E, Structure reports online 20120501
Bis(2-amino-3-carb-oxy-pyridinium) sulfate trihydrate. Acta crystallographica. Section E, Structure reports online 20110401
Practical syntheses of a CXCR3 antagonist. The Journal of organic chemistry 20110318
2-Amino-pyridinium 1-phenyl-cyclo-propane-1-carboxyl-ate. Acta crystallographica. Section E, Structure reports online 20101201
An organogallium subfluoride and subhydroxide: three Ga-Ga bonds in single molecules. Chemical communications (Cambridge, England) 20091128
Efficient solid-phase synthesis of a library of imidazo[1,2-a]pyridine-8-carboxamides. Journal of combinatorial chemistry 20070101
Alkylation activity and molecular properties of two antineoplastic agents that utilise indometacin and a conjugate of aspirin with 2-aminonicotinic acid to transport nitrogen mustard groups. Drugs in R&D 20070101
Diastereoselective formation of metallamacrocyclic (arene)Ru(II) and CpRh(III) complexes. Inorganic chemistry 20040308
Properties