Home Other Building Blocks 2-phenyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethan-1-amine, oxalic acid

2-phenyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethan-1-amine, oxalic acid

CAS No.:
2126176-74-5
Catalog Number:
AG01EJIT
Molecular Formula:
C18H17N3O5
Molecular Weight:
355.3447
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Product Description
Catalog Number:
AG01EJIT
Chemical Name:
2-phenyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethan-1-amine, oxalic acid
CAS Number:
2126176-74-5
Molecular Formula:
C18H17N3O5
Molecular Weight:
355.3447
MDL Number:
MFCD30749859
IUPAC Name:
oxalic acid;2-phenyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)ethanamine
InChI:
InChI=1S/C16H15N3O.C2H2O4/c17-14(11-12-7-3-1-4-8-12)16-18-15(19-20-16)13-9-5-2-6-10-13;3-1(4)2(5)6/h1-10,14H,11,17H2;(H,3,4)(H,5,6)
InChI Key:
YQLKEIAJBKBFHR-UHFFFAOYSA-N
SMILES:
NC(c1onc(n1)c1ccccc1)Cc1ccccc1.OC(=O)C(=O)O
Properties
Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.117g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
355.35g/mol
Monoisotopic Mass:
355.117g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
140A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties