Home Carboxys tert-butyl 1-oxo-2,4-dihydro-1H-spiro[isoquinoline-3,4'-piperidine]-1'-carboxylate

tert-butyl 1-oxo-2,4-dihydro-1H-spiro[isoquinoline-3,4'-piperidine]-1'-carboxylate

CAS No.:
1251021-44-9
Catalog Number:
AG01DJUB
Molecular Formula:
C18H24N2O3
Molecular Weight:
316.3948
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$724
- +
1g
95%
1 week
United States
$1756
- +
Product Description
Catalog Number:
AG01DJUB
Chemical Name:
tert-butyl 1-oxo-2,4-dihydro-1H-spiro[isoquinoline-3,4'-piperidine]-1'-carboxylate
CAS Number:
1251021-44-9
Molecular Formula:
C18H24N2O3
Molecular Weight:
316.3948
MDL Number:
MFCD14581145
IUPAC Name:
tert-butyl 1-oxospiro[2,4-dihydroisoquinoline-3,4'-piperidine]-1'-carboxylate
InChI:
InChI=1S/C18H24N2O3/c1-17(2,3)23-16(22)20-10-8-18(9-11-20)12-13-6-4-5-7-14(13)15(21)19-18/h4-7H,8-12H2,1-3H3,(H,19,21)
InChI Key:
SXIPQAKGHJILBH-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2(CC1)NC(=O)c1c(C2)cccc1)OC(C)(C)C
Properties
Complexity:
475  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.179g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
316.401g/mol
Monoisotopic Mass:
316.179g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties