Home Nitriles 2-ethoxy-2-(4-methylphenyl)acetonitrile

2-ethoxy-2-(4-methylphenyl)acetonitrile

CAS No.:
33224-83-8
Catalog Number:
AG019TUN
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
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Product Description
Catalog Number:
AG019TUN
Chemical Name:
2-ethoxy-2-(4-methylphenyl)acetonitrile
CAS Number:
33224-83-8
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD21684160
IUPAC Name:
2-ethoxy-2-(4-methylphenyl)acetonitrile
InChI:
InChI=1S/C11H13NO/c1-3-13-11(8-12)10-6-4-9(2)5-7-10/h4-7,11H,3H2,1-2H3
InChI Key:
FZBNYJJMJBXXCK-UHFFFAOYSA-N
SMILES:
CCOC(c1ccc(cc1)C)C#N
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties