Home Carboxys (2S,4S)-4-Fluoro-Piperidine-1,2-Dicarboxylic Acid 1-Benzyl Ester

(2S,4S)-4-Fluoro-Piperidine-1,2-Dicarboxylic Acid 1-Benzyl Ester

CAS No.:
1260664-87-6
Catalog Number:
AG00HITQ
Molecular Formula:
C14H16FNO4
Molecular Weight:
281.2795
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Product Description
Catalog Number:
AG00HITQ
Chemical Name:
(2S,4S)-4-Fluoro-Piperidine-1,2-Dicarboxylic Acid 1-Benzyl Ester
CAS Number:
1260664-87-6
Molecular Formula:
C14H16FNO4
Molecular Weight:
281.2795
MDL Number:
MFCD13189898
IUPAC Name:
(2S,4S)-4-fluoro-1-phenylmethoxycarbonylpiperidine-2-carboxylic acid
InChI:
InChI=1S/C14H16FNO4/c15-11-6-7-16(12(8-11)13(17)18)14(19)20-9-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2,(H,17,18)/t11-,12-/m0/s1
InChI Key:
OFKSKDKKCNWFIA-RYUDHWBXSA-N
SMILES:
F[C@H]1CCN([C@@H](C1)C(=O)O)C(=O)OCc1ccccc1
Properties
Complexity:
357  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
281.106g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
281.283g/mol
Monoisotopic Mass:
281.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties