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211108-50-8 | 1-Piperidinecarboxylic acid, 3-fluoro-4-oxo-, 1,1-dimethylethyl ester
CAS No: 211108-50-8 Catalog No: AG002L65 MDL No:MFCD10566554
Product Description
Catalog Number:
AG002L65
Chemical Name:
1-Piperidinecarboxylic acid, 3-fluoro-4-oxo-, 1,1-dimethylethyl ester
CAS Number:
211108-50-8
Molecular Formula:
C10H16FNO3
Molecular Weight:
217.2373
MDL Number:
MFCD10566554
IUPAC Name:
tert-butyl 3-fluoro-4-oxopiperidine-1-carboxylate
InChI:
InChI=1S/C10H16FNO3/c1-10(2,3)15-9(14)12-5-4-8(13)7(11)6-12/h7H,4-6H2,1-3H3
InChI Key:
JZNWQLLPLOQGOI-UHFFFAOYSA-N
SMILES:
O=C1CCN(CC1F)C(=O)OC(C)(C)C
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.24g/mol
Monoisotopic Mass:
217.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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