Home Carboxys 1-Hydroxyisoquinoline-6-carboxylic acid

1-Hydroxyisoquinoline-6-carboxylic acid

CAS No.:
1301214-60-7
Catalog Number:
AG000U13
Molecular Formula:
C10H7NO3
Molecular Weight:
189.1675
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
1 week
United States
$550
- +
Product Description
Catalog Number:
AG000U13
Chemical Name:
1-Hydroxyisoquinoline-6-carboxylic acid
CAS Number:
1301214-60-7
Molecular Formula:
C10H7NO3
Molecular Weight:
189.1675
MDL Number:
MFCD22375648
IUPAC Name:
1-oxo-2H-isoquinoline-6-carboxylic acid
InChI:
InChI=1S/C10H7NO3/c12-9-8-2-1-7(10(13)14)5-6(8)3-4-11-9/h1-5H,(H,11,12)(H,13,14)
InChI Key:
BMHOAEQKRSPMLK-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)cc[nH]c2=O
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.043g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
189.17g/mol
Monoisotopic Mass:
189.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties