Home Carboxys 4-Oxo-3,4-dihydro-phthalazine-1-carboxylic acid

4-Oxo-3,4-dihydro-phthalazine-1-carboxylic acid

CAS No.:
3260-44-4
Catalog Number:
AG00CIUP
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG00CIUP
Chemical Name:
4-Oxo-3,4-dihydro-phthalazine-1-carboxylic acid
CAS Number:
3260-44-4
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
MDL Number:
MFCD00524727
IUPAC Name:
4-oxo-3H-phthalazine-1-carboxylic acid
InChI:
InChI=1S/C9H6N2O3/c12-8-6-4-2-1-3-5(6)7(9(13)14)10-11-8/h1-4H,(H,11,12)(H,13,14)
InChI Key:
YHNOBCUFJJRVOP-UHFFFAOYSA-N
SMILES:
OC(=O)c1n[nH]c(=O)c2c1cccc2
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
190.158g/mol
Monoisotopic Mass:
190.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties