Home Nitriles 2-Amino-4-(4-morpholinyl)benzonitrile

2-Amino-4-(4-morpholinyl)benzonitrile

CAS No.:
28340-72-9
Catalog Number:
AG01EB3U
Molecular Formula:
C11H13N3O
Molecular Weight:
203.2404
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Product Description
Catalog Number:
AG01EB3U
Chemical Name:
2-Amino-4-(4-morpholinyl)benzonitrile
CAS Number:
28340-72-9
Molecular Formula:
C11H13N3O
Molecular Weight:
203.2404
MDL Number:
MFCD22047542
IUPAC Name:
2-amino-4-morpholin-4-ylbenzonitrile
InChI:
InChI=1S/C11H13N3O/c12-8-9-1-2-10(7-11(9)13)14-3-5-15-6-4-14/h1-2,7H,3-6,13H2
InChI Key:
CFOWPTBVYZGHFL-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1N)N1CCOCC1
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.106g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.245g/mol
Monoisotopic Mass:
203.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties