Home Other Building Blocks 4-Hydroxyisoquinolin-1(2h)-one

4-Hydroxyisoquinolin-1(2h)-one

CAS No.:
30081-72-2
Catalog Number:
AG00C419
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$330
- +
1g
95%
1 week
United States
$766
- +
Product Description
Catalog Number:
AG00C419
Chemical Name:
4-Hydroxyisoquinolin-1(2h)-one
CAS Number:
30081-72-2
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
MDL Number:
MFCD01013785
IUPAC Name:
4-hydroxy-2H-isoquinolin-1-one
InChI:
InChI=1S/C9H7NO2/c11-8-5-10-9(12)7-4-2-1-3-6(7)8/h1-5,11H,(H,10,12)
InChI Key:
KOJRWXLHYKLCFJ-UHFFFAOYSA-N
SMILES:
Oc1ncc(c2c1cccc2)O
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties