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Home Nitriles 2-Oxo-2,3-dihydro-1h-benzimidazole-5-carbonitrile

2-Oxo-2,3-dihydro-1h-benzimidazole-5-carbonitrile

CAS No.:
221289-88-9
Catalog Number:
AG00BEZ3
Molecular Formula:
C8H5N3O
Molecular Weight:
159.1448
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$75
- +
1g
98%
In Stock USA
United States
$188
- +
5g
98%
In Stock USA
United States
$569
- +
10g
98%
In Stock USA
United States
$850
- +
25g
98%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00BEZ3
Chemical Name:
2-Oxo-2,3-dihydro-1h-benzimidazole-5-carbonitrile
CAS Number:
221289-88-9
Molecular Formula:
C8H5N3O
Molecular Weight:
159.1448
MDL Number:
MFCD06659795
IUPAC Name:
2-oxo-1,3-dihydrobenzimidazole-5-carbonitrile
InChI:
InChI=1S/C8H5N3O/c9-4-5-1-2-6-7(3-5)11-8(12)10-6/h1-3H,(H2,10,11,12)
InChI Key:
HMERLJKYKSAIMU-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)[nH]c(=O)[nH]2
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.043g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
159.148g/mol
Monoisotopic Mass:
159.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties