Home Carboxys tert-butyl 4-trifluoromethylspiro[indoline-3,4'-piperidine]-1'-carboxylate

tert-butyl 4-trifluoromethylspiro[indoline-3,4'-piperidine]-1'-carboxylate

CAS No.:
1129421-52-8
Catalog Number:
AG00HCGA
Molecular Formula:
C18H23F3N2O2
Molecular Weight:
356.3826
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Product Description
Catalog Number:
AG00HCGA
Chemical Name:
tert-butyl 4-trifluoromethylspiro[indoline-3,4'-piperidine]-1'-carboxylate
CAS Number:
1129421-52-8
Molecular Formula:
C18H23F3N2O2
Molecular Weight:
356.3826
MDL Number:
MFCD20259871
IUPAC Name:
tert-butyl 4-(trifluoromethyl)spiro[1,2-dihydroindole-3,4'-piperidine]-1'-carboxylate
InChI:
InChI=1S/C18H23F3N2O2/c1-16(2,3)25-15(24)23-9-7-17(8-10-23)11-22-13-6-4-5-12(14(13)17)18(19,20)21/h4-6,22H,7-11H2,1-3H3
InChI Key:
LZUATKFQCAMJLE-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2(CC1)CNc1c2c(ccc1)C(F)(F)F)OC(C)(C)C
Properties
Complexity:
507  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.171g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
356.389g/mol
Monoisotopic Mass:
356.171g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties