Home Carboxys tert-butyl 2-(trifluoromethyl)-1,8-diazaspiro[4.5]decane-8-carboxylate

tert-butyl 2-(trifluoromethyl)-1,8-diazaspiro[4.5]decane-8-carboxylate

CAS No.:
1251020-85-5
Catalog Number:
AG01DJMP
Molecular Formula:
C14H23F3N2O2
Molecular Weight:
308.3398
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Product Description
Catalog Number:
AG01DJMP
Chemical Name:
tert-butyl 2-(trifluoromethyl)-1,8-diazaspiro[4.5]decane-8-carboxylate
CAS Number:
1251020-85-5
Molecular Formula:
C14H23F3N2O2
Molecular Weight:
308.3398
MDL Number:
MFCD17016184
IUPAC Name:
tert-butyl 2-(trifluoromethyl)-1,8-diazaspiro[4.5]decane-8-carboxylate
InChI:
InChI=1S/C14H23F3N2O2/c1-12(2,3)21-11(20)19-8-6-13(7-9-19)5-4-10(18-13)14(15,16)17/h10,18H,4-9H2,1-3H3
InChI Key:
VCGIXNJTEPLEJZ-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2(CC1)CCC(N2)C(F)(F)F)OC(C)(C)C
Properties
Complexity:
396  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.171g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
308.345g/mol
Monoisotopic Mass:
308.171g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties