Home Boronic acids Isoquinoline-7-boronic acid

Isoquinoline-7-boronic acid

CAS No.:
1092790-21-0
Catalog Number:
AG008UAG
Molecular Formula:
C9H8BNO2
Molecular Weight:
172.9763
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$125
- +
1g
95%
In Stock USA
United States
$313
- +
5g
95%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG008UAG
Chemical Name:
Isoquinoline-7-boronic acid
CAS Number:
1092790-21-0
Molecular Formula:
C9H8BNO2
Molecular Weight:
172.9763
MDL Number:
MFCD08234617
IUPAC Name:
isoquinolin-7-ylboronic acid
InChI:
InChI=1S/C9H8BNO2/c12-10(13)9-2-1-7-3-4-11-6-8(7)5-9/h1-6,12-13H
InChI Key:
SVSZHSMOMDNMLS-UHFFFAOYSA-N
SMILES:
OB(c1ccc2c(c1)cncc2)O
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.065g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
172.978g/mol
Monoisotopic Mass:
173.065g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties