Home Carbonyls Cis-1-(Tert-Butoxycarbonyl)-3A,4,5,6A-Tetrahydrospiro[Cyclopenta[D]Isoxazole-6,4-Piperidine]-3-Carboxylic Acid

Cis-1-(Tert-Butoxycarbonyl)-3A,4,5,6A-Tetrahydrospiro[Cyclopenta[D]Isoxazole-6,4-Piperidine]-3-Carboxylic Acid

CAS No.:
1273564-79-6
Catalog Number:
AG00HROK
Molecular Formula:
C16H24N2O5
Molecular Weight:
324.3722
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$315
- +
250mg
95%
In Stock USA
United States
$588
- +
1g
95%
In Stock USA
United States
$1176
- +
Product Description
Catalog Number:
AG00HROK
Chemical Name:
Cis-1-(Tert-Butoxycarbonyl)-3A,4,5,6A-Tetrahydrospiro[Cyclopenta[D]Isoxazole-6,4-Piperidine]-3-Carboxylic Acid
CAS Number:
1273564-79-6
Molecular Formula:
C16H24N2O5
Molecular Weight:
324.3722
MDL Number:
MFCD25509311
IUPAC Name:
(3aS,6aR)-1'-[(2-methylpropan-2-yl)oxycarbonyl]spiro[3a,4,5,6a-tetrahydrocyclopenta[d][1,2]oxazole-6,4'-piperidine]-3-carboxylic acid
InChI:
InChI=1S/C16H24N2O5/c1-15(2,3)22-14(21)18-8-6-16(7-9-18)5-4-10-11(13(19)20)17-23-12(10)16/h10,12H,4-9H2,1-3H3,(H,19,20)/t10-,12+/m0/s1
InChI Key:
IGFBJJHCHYRZKG-CMPLNLGQSA-N
SMILES:
O=C(N1CCC2(CC1)CC[C@@H]1[C@H]2ON=C1C(=O)O)OC(C)(C)C
Properties
Complexity:
543  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
324.169g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
324.377g/mol
Monoisotopic Mass:
324.169g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
88.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties