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

4-(1,3,4-oxadiazol-2-yl)piperidine, trifluoroacetic acid

CAS No.:
1803604-13-8
Catalog Number:
AG01BAJT
Molecular Formula:
C9H12F3N3O3
Molecular Weight:
267.2051
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Product Description
Catalog Number:
AG01BAJT
Chemical Name:
4-(1,3,4-oxadiazol-2-yl)piperidine, trifluoroacetic acid
CAS Number:
1803604-13-8
Molecular Formula:
C9H12F3N3O3
Molecular Weight:
267.2051
MDL Number:
MFCD28397672
IUPAC Name:
2-piperidin-4-yl-1,3,4-oxadiazole;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C7H11N3O.C2HF3O2/c1-3-8-4-2-6(1)7-10-9-5-11-7;3-2(4,5)1(6)7/h5-6,8H,1-4H2;(H,6,7)
InChI Key:
MMYKAXRZGCGYOG-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)c1ocnn1.OC(=O)C(F)(F)F
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.083g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
267.208g/mol
Monoisotopic Mass:
267.083g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties