Home Nitriles 4-methoxybut-2-enenitrile

4-methoxybut-2-enenitrile

CAS No.:
80355-38-0
Catalog Number:
AG01BHJC
Molecular Formula:
C5H7NO
Molecular Weight:
97.1152
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BHJC
Chemical Name:
4-methoxybut-2-enenitrile
CAS Number:
80355-38-0
Molecular Formula:
C5H7NO
Molecular Weight:
97.1152
MDL Number:
MFCD28145287
IUPAC Name:
4-methoxybut-2-enenitrile
InChI:
InChI=1S/C5H7NO/c1-7-5-3-2-4-6/h2-3H,5H2,1H3
InChI Key:
GPNISLPZDBITJJ-UHFFFAOYSA-N
SMILES:
COCC=CC#N
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:
97.053g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
97.117g/mol
Monoisotopic Mass:
97.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
0.1  
Properties