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26487-09-2 | Benzamide, 2-cyano-N,N-diethyl-
CAS No: 26487-09-2 Catalog No: AG002TF9 MDL No:
Product Description
Catalog Number:
AG002TF9
Chemical Name:
Benzamide, 2-cyano-N,N-diethyl-
CAS Number:
26487-09-2
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
IUPAC Name:
2-cyano-N,N-diethylbenzamide
InChI:
InChI=1S/C12H14N2O/c1-3-14(4-2)12(15)11-8-6-5-7-10(11)9-13/h5-8H,3-4H2,1-2H3
InChI Key:
XOMKANZUMUDGKF-UHFFFAOYSA-N
SMILES:
CCN(C(=O)c1ccccc1C#N)CC
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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