Home Nitriles 3-methoxy-2,2-dimethylpropanenitrile

3-methoxy-2,2-dimethylpropanenitrile

CAS No.:
99705-29-0
Catalog Number:
AG00KDJC
Molecular Formula:
C6H11NO
Molecular Weight:
113.1576
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00KDJC
Chemical Name:
3-methoxy-2,2-dimethylpropanenitrile
CAS Number:
99705-29-0
Molecular Formula:
C6H11NO
Molecular Weight:
113.1576
MDL Number:
MFCD16251437
IUPAC Name:
3-methoxy-2,2-dimethylpropanenitrile
InChI:
InChI=1S/C6H11NO/c1-6(2,4-7)5-8-3/h5H2,1-3H3
InChI Key:
CEMLHCYKDRPMSS-UHFFFAOYSA-N
SMILES:
COCC(C#N)(C)C
Properties
Complexity:
109  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.084g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
113.16g/mol
Monoisotopic Mass:
113.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties