Home Nitriles 5-Hydroxyisophthalonitrile

5-Hydroxyisophthalonitrile

CAS No.:
79370-78-8
Catalog Number:
AG003MSP
Molecular Formula:
C8H4N2O
Molecular Weight:
144.1302
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$32
- +
5g
98%
In Stock USA
United States
$94
- +
10g
98%
In Stock USA
United States
$150
- +
25g
98%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG003MSP
Chemical Name:
5-Hydroxyisophthalonitrile
CAS Number:
79370-78-8
Molecular Formula:
C8H4N2O
Molecular Weight:
144.1302
MDL Number:
MFCD11865326
IUPAC Name:
5-hydroxybenzene-1,3-dicarbonitrile
InChI:
InChI=1S/C8H4N2O/c9-4-6-1-7(5-10)3-8(11)2-6/h1-3,11H
InChI Key:
CHASTCUDJNQBOZ-UHFFFAOYSA-N
SMILES:
N#Cc1cc(O)cc(c1)C#N
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.032g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
144.133g/mol
Monoisotopic Mass:
144.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties