Home Nitriles 4-[2-(dimethylamino)ethoxy]-3-methoxybenzonitrile

4-[2-(dimethylamino)ethoxy]-3-methoxybenzonitrile

CAS No.:
938368-56-0
Catalog Number:
AG019V6E
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
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Product Description
Catalog Number:
AG019V6E
Chemical Name:
4-[2-(dimethylamino)ethoxy]-3-methoxybenzonitrile
CAS Number:
938368-56-0
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
MDL Number:
MFCD09717755
IUPAC Name:
4-[2-(dimethylamino)ethoxy]-3-methoxybenzonitrile
InChI:
InChI=1S/C12H16N2O2/c1-14(2)6-7-16-11-5-4-10(9-13)8-12(11)15-3/h4-5,8H,6-7H2,1-3H3
InChI Key:
RCUCEBNAIPYRHF-UHFFFAOYSA-N
SMILES:
COc1cc(C#N)ccc1OCCN(C)C
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.121g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.272g/mol
Monoisotopic Mass:
220.121g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties