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Home > Fluorides > 1405128-38-2
1405128-38-2 | Carbamic acid, N-[(3S,5R)-5-fluoro-3-piperidinyl]-, 1,1-dimethylethyl ester
CAS No: 1405128-38-2 Catalog No: AG001CJD MDL No:MFCD21609465
Product Description
Catalog Number:
AG001CJD
Chemical Name:
Carbamic acid, N-[(3S,5R)-5-fluoro-3-piperidinyl]-, 1,1-dimethylethyl ester
CAS Number:
1405128-38-2
Molecular Formula:
C10H19FN2O2
Molecular Weight:
218.2685
MDL Number:
MFCD21609465
IUPAC Name:
tert-butyl N-[(3S,5R)-5-fluoropiperidin-3-yl]carbamate
InChI:
InChI=1S/C10H19FN2O2/c1-10(2,3)15-9(14)13-8-4-7(11)5-12-6-8/h7-8,12H,4-6H2,1-3H3,(H,13,14)/t7-,8+/m1/s1
InChI Key:
ACHGEWOGBWGEEL-SFYZADRCSA-N
SMILES:
F[C@H]1CNC[C@H](C1)NC(=O)OC(C)(C)C
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
218.143g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
218.272g/mol
Monoisotopic Mass:
218.143g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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