Home Other Building Blocks 3-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine, trifluoroacetic acid

3-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine, trifluoroacetic acid

CAS No.:
1803592-65-5
Catalog Number:
AG01BEGG
Molecular Formula:
C9H12F3N3O4
Molecular Weight:
283.2045
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Product Description
Catalog Number:
AG01BEGG
Chemical Name:
3-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine, trifluoroacetic acid
CAS Number:
1803592-65-5
Molecular Formula:
C9H12F3N3O4
Molecular Weight:
283.2045
MDL Number:
MFCD28064007
IUPAC Name:
3-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C7H11N3O2.C2HF3O2/c1-5-9-10-7(12-5)6-4-11-3-2-8-6;3-2(4,5)1(6)7/h6,8H,2-4H2,1H3;(H,6,7)
InChI Key:
NBWNRDQWKVGRMC-UHFFFAOYSA-N
SMILES:
OC(=O)C(F)(F)F.Cc1nnc(o1)C1NCCOC1
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.078g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
283.207g/mol
Monoisotopic Mass:
283.078g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
97.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties