Home Nitriles (2E)-4,4-Dimethoxy-3-methylbut-2-enenitrile

(2E)-4,4-Dimethoxy-3-methylbut-2-enenitrile

CAS No.:
84586-19-6
Catalog Number:
AG00IDEI
Molecular Formula:
C7H11NO2
Molecular Weight:
141.1677
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$188
- +
5g
96%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG00IDEI
Chemical Name:
(2E)-4,4-Dimethoxy-3-methylbut-2-enenitrile
CAS Number:
84586-19-6
Molecular Formula:
C7H11NO2
Molecular Weight:
141.1677
MDL Number:
MFCD28515387
IUPAC Name:
(E)-4,4-dimethoxy-3-methylbut-2-enenitrile
InChI:
InChI=1S/C7H11NO2/c1-6(4-5-8)7(9-2)10-3/h4,7H,1-3H3/b6-4+
InChI Key:
VCEORIKGLMGDRB-GQCTYLIASA-N
SMILES:
COC(/C(=C/C#N)/C)OC
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
141.079g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.17g/mol
Monoisotopic Mass:
141.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties