Home Other Building Blocks N-cyclobutylazetidin-3-amine, bis(trifluoroacetic acid)

N-cyclobutylazetidin-3-amine, bis(trifluoroacetic acid)

CAS No.:
2126176-83-6
Catalog Number:
AG01EK2D
Molecular Formula:
C11H16F6N2O4
Molecular Weight:
354.2462
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Product Description
Catalog Number:
AG01EK2D
Chemical Name:
N-cyclobutylazetidin-3-amine, bis(trifluoroacetic acid)
CAS Number:
2126176-83-6
Molecular Formula:
C11H16F6N2O4
Molecular Weight:
354.2462
MDL Number:
MFCD30752560
IUPAC Name:
N-cyclobutylazetidin-3-amine;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C7H14N2.2C2HF3O2/c1-2-6(3-1)9-7-4-8-5-7;2*3-2(4,5)1(6)7/h6-9H,1-5H2;2*(H,6,7)
InChI Key:
IZASXRAARJNTME-UHFFFAOYSA-N
SMILES:
C1CC(C1)NC1CNC1.OC(=O)C(F)(F)F.OC(=O)C(F)(F)F
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.101g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
354.249g/mol
Monoisotopic Mass:
354.101g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
98.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties