Home Nitriles (4-Methyl-1h-imidazol-5-yl)acetonitrile

(4-Methyl-1h-imidazol-5-yl)acetonitrile

CAS No.:
51667-66-4
Catalog Number:
AG00DCY6
Molecular Formula:
C6H7N3
Molecular Weight:
121.1399
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
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Product Description
Catalog Number:
AG00DCY6
Chemical Name:
(4-Methyl-1h-imidazol-5-yl)acetonitrile
CAS Number:
51667-66-4
Molecular Formula:
C6H7N3
Molecular Weight:
121.1399
MDL Number:
MFCD16710300
IUPAC Name:
2-(5-methyl-1H-imidazol-4-yl)acetonitrile
InChI:
InChI=1S/C6H7N3/c1-5-6(2-3-7)9-4-8-5/h4H,2H2,1H3,(H,8,9)
InChI Key:
RREQMVIEIZZIPD-UHFFFAOYSA-N
SMILES:
Cc1c(CC#N)nc[nH]1
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
121.064g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
121.143g/mol
Monoisotopic Mass:
121.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties