sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 2-Naphthalenecarboxylic acid, 6-amino-

2-Naphthalenecarboxylic acid, 6-amino-

CAS No.:
116668-47-4
Catalog Number:
AG000CYA
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
92%
In Stock USA
United States
$126
- +
1g
92%
In Stock USA
United States
$201
- +
5g
92%
In Stock USA
United States
$416
- +
Product Description
Catalog Number:
AG000CYA
Chemical Name:
2-Naphthalenecarboxylic acid, 6-amino-
CAS Number:
116668-47-4
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
MDL Number:
MFCD01861831
IUPAC Name:
6-aminonaphthalene-2-carboxylic acid
InChI:
InChI=1S/C11H9NO2/c12-10-4-3-7-5-9(11(13)14)2-1-8(7)6-10/h1-6H,12H2,(H,13,14)
InChI Key:
NZTPZUIIYNYZKT-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)ccc(c2)C(=O)O
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.063g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
187.198g/mol
Monoisotopic Mass:
187.063g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Fragment-based design of symmetrical bis-benzimidazoles as selective inhibitors of the trimethoprim-resistant, type II R67 dihydrofolate reductase. Journal of medicinal chemistry 20120412
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Properties