Home Nitriles 2-ethoxy-3-methylbutanenitrile

2-ethoxy-3-methylbutanenitrile

CAS No.:
1479205-96-3
Catalog Number:
AG01AFER
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AFER
Chemical Name:
2-ethoxy-3-methylbutanenitrile
CAS Number:
1479205-96-3
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
MDL Number:
MFCD21684165
IUPAC Name:
2-ethoxy-3-methylbutanenitrile
InChI:
InChI=1S/C7H13NO/c1-4-9-7(5-8)6(2)3/h6-7H,4H2,1-3H3
InChI Key:
AKUZONKAWGDQFX-UHFFFAOYSA-N
SMILES:
CCOC(C(C)C)C#N
Properties
Complexity:
111  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.1g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties