Home Nitriles 2-methoxy-2-methylpropanenitrile

2-methoxy-2-methylpropanenitrile

CAS No.:
76474-09-4
Catalog Number:
AG019TH1
Molecular Formula:
C5H9NO
Molecular Weight:
99.1311
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Product Description
Catalog Number:
AG019TH1
Chemical Name:
2-methoxy-2-methylpropanenitrile
CAS Number:
76474-09-4
Molecular Formula:
C5H9NO
Molecular Weight:
99.1311
MDL Number:
MFCD21648802
IUPAC Name:
2-methoxy-2-methylpropanenitrile
InChI:
InChI=1S/C5H9NO/c1-5(2,4-6)7-3/h1-3H3
InChI Key:
GREBWGAVFUQVPM-UHFFFAOYSA-N
SMILES:
COC(C#N)(C)C
Properties
Complexity:
97.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
99.068g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
99.133g/mol
Monoisotopic Mass:
99.068g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties