Home Carboxys Isoquinoline-4-carboxylic acid

Isoquinoline-4-carboxylic acid

CAS No.:
7159-36-6
Catalog Number:
AG00FAKJ
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG00FAKJ
Chemical Name:
Isoquinoline-4-carboxylic acid
CAS Number:
7159-36-6
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
MDL Number:
MFCD00094344
IUPAC Name:
isoquinoline-4-carboxylic acid
InChI:
InChI=1S/C10H7NO2/c12-10(13)9-6-11-5-7-3-1-2-4-8(7)9/h1-6H,(H,12,13)
InChI Key:
MCVMLYSLPCECGO-UHFFFAOYSA-N
SMILES:
OC(=O)c1cncc2c1cccc2
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.048g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.171g/mol
Monoisotopic Mass:
173.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties