Home Nitriles 2-methoxy-2-(1-methyl-1H-pyrazol-4-yl)acetonitrile

2-methoxy-2-(1-methyl-1H-pyrazol-4-yl)acetonitrile

CAS No.:
1484437-84-4
Catalog Number:
AG01B7LX
Molecular Formula:
C7H9N3O
Molecular Weight:
151.1659
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Product Description
Catalog Number:
AG01B7LX
Chemical Name:
2-methoxy-2-(1-methyl-1H-pyrazol-4-yl)acetonitrile
CAS Number:
1484437-84-4
Molecular Formula:
C7H9N3O
Molecular Weight:
151.1659
MDL Number:
MFCD21684313
IUPAC Name:
2-methoxy-2-(1-methylpyrazol-4-yl)acetonitrile
InChI:
InChI=1S/C7H9N3O/c1-10-5-6(4-9-10)7(3-8)11-2/h4-5,7H,1-2H3
InChI Key:
OBRHWYUKMDCTJB-UHFFFAOYSA-N
SMILES:
COC(c1cnn(c1)C)C#N
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.075g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.169g/mol
Monoisotopic Mass:
151.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties