AG00A0CC

1303973-94-5 | 3-(Boc-aMino)-5,5-difluoropiperidine

AG00A0CC

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CAS Number	1303973-94-5
Catalog Number	AG00A0CC(AGN-PC-0WALDX)
Chemical Name	3-(Boc-aMino)-5,5-difluoropiperidine
IUPAC Name	tert-butyl N-(5,5-difluoropiperidin-3-yl)carbamate
InChI	InChI=1S/C10H18F2N2O2/c1-9(2,3)16-8(15)14-7-4-10(11,12)6-13-5-7/h7,13H,4-6H2,1-3H3,(H,14,15)
InChI Key	NZEASWFMIYVAAZ-UHFFFAOYSA-N
MDL Number	MFCD18909872
Molecular Formula	C10H18F2N2O2
Molecular Weight	236.2589
SMILES	O=C(OC(C)(C)C)NC1CNCC(F)(F)C1
Synonyms	1303973-94-5, 3-(BOC-AMINO)-5,5-DIFLUOROPIPERIDINE, tert-Butyl (5,5-difluoropiperidin-3-yl)carbamate, tert-butyl N-(5,5-difluoropiperidin-3-yl)carbamate, SCHEMBL17764653, MFCD18909872, AKOS023601216, FCH1621940, PB13899, KS-0000072X, AK172039, AS-34503, ST1040223, CS-0048063, Q-3899, tert-Butyl N-(5,5-difluoro-3-piperidyl)carbamate, TERT-BUTYL 5,5-DIFLUOROPIPERIDIN-3-YLCARBAMATE,

Complexity	264
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	236.134g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	236.263g/mol
Monoisotopic Mass	236.134g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	50.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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

Lot Number