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Home Nitriles alpha-(4-methoxyphenyl)morpholine-4-acetonitrile

alpha-(4-methoxyphenyl)morpholine-4-acetonitrile

CAS No.:
15190-13-3
Catalog Number:
AG00AL1I
Molecular Formula:
C13H16N2O2
Molecular Weight:
232.2783
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Product Description
Catalog Number:
AG00AL1I
Chemical Name:
alpha-(4-methoxyphenyl)morpholine-4-acetonitrile
CAS Number:
15190-13-3
Molecular Formula:
C13H16N2O2
Molecular Weight:
232.2783
MDL Number:
MFCD00023356
IUPAC Name:
2-(4-methoxyphenyl)-2-morpholin-4-ylacetonitrile
InChI:
InChI=1S/C13H16N2O2/c1-16-12-4-2-11(3-5-12)13(10-14)15-6-8-17-9-7-15/h2-5,13H,6-9H2,1H3
InChI Key:
FFBHHRZLHWDGQN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(N1CCOCC1)C#N
EC Number:
239-245-5
NSC Number:
163359
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.121g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.283g/mol
Monoisotopic Mass:
232.121g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties