Home Nitriles 2-ethoxyacetonitrile

2-ethoxyacetonitrile

CAS No.:
62957-60-2
Catalog Number:
AG00EL2T
Molecular Formula:
C4H7NO
Molecular Weight:
85.1045
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Product Description
Catalog Number:
AG00EL2T
Chemical Name:
2-ethoxyacetonitrile
CAS Number:
62957-60-2
Molecular Formula:
C4H7NO
Molecular Weight:
85.1045
MDL Number:
MFCD09934087
IUPAC Name:
2-ethoxyacetonitrile
InChI:
InChI=1S/C4H7NO/c1-2-6-4-3-5/h2,4H2,1H3
InChI Key:
WPYUCWSMVJJWFI-UHFFFAOYSA-N
SMILES:
CCOCC#N
Properties
Complexity:
61.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
85.053g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
85.106g/mol
Monoisotopic Mass:
85.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties