Home Nitriles 2-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzonitrile

2-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzonitrile

CAS No.:
1019120-04-7
Catalog Number:
AG01AHR3
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
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Product Description
Catalog Number:
AG01AHR3
Chemical Name:
2-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzonitrile
CAS Number:
1019120-04-7
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD11131219
IUPAC Name:
2-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzonitrile
InChI:
InChI=1S/C11H10N2O2/c12-7-9-3-1-2-4-10(9)8-13-5-6-15-11(13)14/h1-4H,5-6,8H2
InChI Key:
KGGVANSYVXRQRH-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1CN1CCOC1=O
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties