Home Nitriles 2-ethoxy-2-phenylacetonitrile

2-ethoxy-2-phenylacetonitrile

CAS No.:
33224-69-0
Catalog Number:
AG01AFFD
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
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Product Description
Catalog Number:
AG01AFFD
Chemical Name:
2-ethoxy-2-phenylacetonitrile
CAS Number:
33224-69-0
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
MDL Number:
MFCD21684261
IUPAC Name:
2-ethoxy-2-phenylacetonitrile
InChI:
InChI=1S/C10H11NO/c1-2-12-10(8-11)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3
InChI Key:
RTTFWOLWRMFSKA-UHFFFAOYSA-N
SMILES:
CCOC(c1ccccc1)C#N
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties