Home Nitriles 4-Benzyl-2-morpholineacetonitrile

4-Benzyl-2-morpholineacetonitrile

CAS No.:
57962-45-5
Catalog Number:
AG00EDUS
Molecular Formula:
C13H16N2O
Molecular Weight:
216.2789
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00EDUS
Chemical Name:
4-Benzyl-2-morpholineacetonitrile
CAS Number:
57962-45-5
Molecular Formula:
C13H16N2O
Molecular Weight:
216.2789
MDL Number:
MFCD04038496
IUPAC Name:
2-(4-benzylmorpholin-2-yl)acetonitrile
InChI:
InChI=1S/C13H16N2O/c14-7-6-13-11-15(8-9-16-13)10-12-4-2-1-3-5-12/h1-5,13H,6,8-11H2
InChI Key:
IMCDTSZTCIFXNN-UHFFFAOYSA-N
SMILES:
N#CCC1OCCN(C1)Cc1ccccc1
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.126g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.284g/mol
Monoisotopic Mass:
216.126g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties