6-fluoro-2-azaspiro[3.3]heptane; trifluoroacetic acid

6-fluoro-2-azaspiro[3.3]heptane; trifluoroacetic acid

CAS: 2227205-88-9

Formula: C8H11F4NO2

SMILES: OC(=O)C(F)(F)F.FC1CC2(CNC2)C1

IUPAC: 6-fluoro-2-azaspiro[3.3]heptane; trifluoroacetic acid

InChI: InChI=1S/C6H10FN.C2HF3O2/c7-5-1-6(2-5)3-8-4-6;3-2(4,5)1(6)7/h5,8H,1-4H2;(H,6,7)

Composition: C (41.93%), H (4.84%), F (33.16%), N (6.11%), O (13.96%)

Molar Mass: 229.175

Atom Count: 26

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	229.07259125
Formal Charge	0
FSP3	0.87
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	JOZKYAXYZDTMHA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	29.13
Topological Polar Surface Area	12.03
Polarizability	11.56
Ring Count	2
Rotatable Bond Count	1

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