AG000WYP

1273565-65-3 | 1-Piperidinecarboxylic acid, 3-amino-4-fluoro-, 1,1-dimethylethyl ester, (3R,4S)-rel-

AG000WYP

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CAS Number	1273565-65-3
Catalog Number	AG000WYP(AGN-PC-0WB004)
Chemical Name	1-Piperidinecarboxylic acid, 3-amino-4-fluoro-, 1,1-dimethylethyl ester, (3R,4S)-rel-
IUPAC Name	tert-butyl (3S,4R)-3-amino-4-fluoropiperidine-1-carboxylate
InChI	InChI=1S/C10H19FN2O2/c1-10(2,3)15-9(14)13-5-4-7(11)8(12)6-13/h7-8H,4-6,12H2,1-3H3/t7-,8+/m1/s1
InChI Key	CVHJEFDRBTZVEL-SFYZADRCSA-N
MDL Number	MFCD18791212
Molecular Formula	C10H19FN2O2
Molecular Weight	218.2685
SMILES	O=C(N1C[C@@H](N)[C@@H](F)CC1)OC(C)(C)C
Synonyms	1273565-65-3, (3s,4r)-rel-3-amino-1-boc-4-fluoropiperidine, 1290191-73-9, (3S,4R)-tert-butyl 3-amino-4-fluoropiperidine-1-carboxylate, tert-butyl (3S,4R)-3-amino-4-fluoropiperidine-1-carboxylate, tert-butyl cis-3-amino-4-fluoropiperidine-1-carboxylate, cis-3-amino-1-boc-4-fluoropiperidine, SCHEMBL15896772, CVHJEFDRBTZVEL-SFYZADRCSA-N, tert-Butyl (3S,4R)-3-amino-4-fluoro-piperidine-1-carboxylate, BBL103295, MFCD18791212, MFCD23106311, STL557105, ZINC72267112, AKOS025312358, GS-6381, PB37197, SB10638, KS-000003Z4, PC430172, (3S,4R)-1-Boc-4-fluoro-3-piperidinamine, CS-0052939, (3,4)-cis-tert-Butyl 3-amino-4-fluoropiperidine-1-carboxylate, (3,4)-cis-tert-Butyl3-amino-4-fluoropiperidine-1-carboxylate-, CIS-TERT-BUTYL 3-AMINO-4-FLUOROPIPERIDINE-1-CARBOXYLATE, (3,4)-cis-tert-butyl3-amino-4-fluoropiperidine-1-carboxylateracemate, 1-iperidinecarboxylic acid, 3-mino-4-luoro-, 1,1-imethylethyl ester, (3S,4R)-, 1-Piperidinecarboxylic acid, 3-amino-4-fluoro-, 1,1-dimethylethyl ester, (3R,4R)-rel-, tert-butyl cis-3-amino-4-fluoro-piperidine-1-carboxylate, 1273567-30-8,

Complexity	240
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	1
Isotope Atom Count	0
Molecular Weight	218.272g/mol
Monoisotopic Mass	218.143g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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