Home Other Building Blocks 4-ETHYLPHENYLACETONITRILE

4-ETHYLPHENYLACETONITRILE

CAS No.:
51632-28-1
Catalog Number:
AG003LCA
Molecular Formula:
C10H11N
Molecular Weight:
145.2010
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Product Description
Catalog Number:
AG003LCA
Chemical Name:
4-ETHYLPHENYLACETONITRILE
CAS Number:
51632-28-1
Molecular Formula:
C10H11N
Molecular Weight:
145.2010
MDL Number:
MFCD00040893
IUPAC Name:
2-(4-ethylphenyl)acetonitrile
InChI:
InChI=1S/C10H11N/c1-2-9-3-5-10(6-4-9)7-8-11/h3-6H,2,7H2,1H3
InChI Key:
NCPKDFDQDZMXCO-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)CC#N
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.089g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.205g/mol
Monoisotopic Mass:
145.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties