Home Carboxys Cis-3-fluoro-4-hydroxy-5,5-dimethylpiperidine-1-carboxylic acid tert-butyl ester

Cis-3-fluoro-4-hydroxy-5,5-dimethylpiperidine-1-carboxylic acid tert-butyl ester

CAS No.:
1612176-00-7
Catalog Number:
AG001S9G
Molecular Formula:
C12H22FNO3
Molecular Weight:
247.3064
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$778
- +
5g
97%
1 week
United States
$2260
- +
Product Description
Catalog Number:
AG001S9G
Chemical Name:
Cis-3-fluoro-4-hydroxy-5,5-dimethylpiperidine-1-carboxylic acid tert-butyl ester
CAS Number:
1612176-00-7
Molecular Formula:
C12H22FNO3
Molecular Weight:
247.3064
MDL Number:
MFCD27988130
IUPAC Name:
tert-butyl (4R,5S)-5-fluoro-4-hydroxy-3,3-dimethylpiperidine-1-carboxylate
InChI:
InChI=1S/C12H22FNO3/c1-11(2,3)17-10(16)14-6-8(13)9(15)12(4,5)7-14/h8-9,15H,6-7H2,1-5H3/t8-,9-/m0/s1
InChI Key:
ZXQXELYTJRBLOD-IUCAKERBSA-N
SMILES:
F[C@H]1CN(CC([C@H]1O)(C)C)C(=O)OC(C)(C)C
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
247.158g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.31g/mol
Monoisotopic Mass:
247.158g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties