Home Nitriles (1-Methyl-1H-pyrazol-3-yl)-acetonitrile

(1-Methyl-1H-pyrazol-3-yl)-acetonitrile

CAS No.:
1142927-97-6
Catalog Number:
AG00970Z
Molecular Formula:
C6H7N3
Molecular Weight:
121.1399
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Product Description
Catalog Number:
AG00970Z
Chemical Name:
(1-Methyl-1H-pyrazol-3-yl)-acetonitrile
CAS Number:
1142927-97-6
Molecular Formula:
C6H7N3
Molecular Weight:
121.1399
MDL Number:
MFCD18262385
IUPAC Name:
2-(1-methylpyrazol-3-yl)acetonitrile
InChI:
InChI=1S/C6H7N3/c1-9-5-3-6(8-9)2-4-7/h3,5H,2H2,1H3
InChI Key:
FCZKETPZEHWCAI-UHFFFAOYSA-N
SMILES:
Cn1ccc(n1)CC#N
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:
0
Isotope Atom Count:
0
Molecular Weight:
121.143g/mol
Monoisotopic Mass:
121.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties