Home Other Building Blocks Isoniazid-d4

Isoniazid-d4

CAS No.:
774596-24-6
Catalog Number:
AG008MUB
Molecular Formula:
C6H3D4N3O
Molecular Weight:
141.1639
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG008MUB
Chemical Name:
Isoniazid-d4
CAS Number:
774596-24-6
Molecular Formula:
C6H3D4N3O
Molecular Weight:
141.1639
MDL Number:
MFCD09840815
IUPAC Name:
2,3,5,6-tetradeuteriopyridine-4-carbohydrazide
InChI:
InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)/i1D,2D,3D,4D
InChI Key:
QRXWMOHMRWLFEY-RHQRLBAQSA-N
SMILES:
NNC(=O)c1c([2H])c([2H])nc(c1[2H])[2H]
Properties
Complexity:
120  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
4  
Molecular Weight:
141.166g/mol
Monoisotopic Mass:
141.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties