Home Carboxys 4-hydroxy-7-nitroquinoline-3-carboxylic acid

4-hydroxy-7-nitroquinoline-3-carboxylic acid

CAS No.:
40107-11-7
Catalog Number:
AG01AE8J
Molecular Formula:
C10H6N2O5
Molecular Weight:
234.1650
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AE8J
Chemical Name:
4-hydroxy-7-nitroquinoline-3-carboxylic acid
CAS Number:
40107-11-7
Molecular Formula:
C10H6N2O5
Molecular Weight:
234.1650
MDL Number:
MFCD12922869
IUPAC Name:
7-nitro-4-oxo-1H-quinoline-3-carboxylic acid
InChI:
InChI=1S/C10H6N2O5/c13-9-6-2-1-5(12(16)17)3-8(6)11-4-7(9)10(14)15/h1-4H,(H,11,13)(H,14,15)
InChI Key:
HGHKRTOZDXYURD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)ncc(c2O)C(=O)O
NSC Number:
307164
Properties
Complexity:
411  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.028g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.167g/mol
Monoisotopic Mass:
234.028g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties