AG00BFM7

281652-10-6 | tert-Butyl 4,4-difluoropiperidine-1-carboxylate

AG00BFM7

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CAS Number	281652-10-6
Catalog Number	AG00BFM7(AGN-PC-037D7W)
Chemical Name	tert-Butyl 4,4-difluoropiperidine-1-carboxylate
IUPAC Name	tert-butyl 4,4-difluoropiperidine-1-carboxylate
InChI	InChI=1S/C10H17F2NO2/c1-9(2,3)15-8(14)13-6-4-10(11,12)5-7-13/h4-7H2,1-3H3
InChI Key	HHBBBPZPEBZLII-UHFFFAOYSA-N
MDL Number	MFCD11054110
Molecular Formula	C10H17F2NO2
Molecular Weight	221.2443
SMILES	O=C(N1CCC(F)(F)CC1)OC(C)(C)C
Synonyms	tert-butyl 4,4-difluoropiperidine-1-carboxylate, 281652-10-6, 1-N-BOC-4,4-DIFLUOROPIPERIDINE, 1-Boc-4,4-difluoropiperidine, tert-Butyl 4,4-difluoro-1-piperidinecarboxylate, C10H17F2NO2, 4,4-Difluoro-piperidine-1-carboxylic acid tert-butyl ester, 1-N-Boc-4-difluoropiperidine, SCHEMBL6228410, CTK4G0944, HHBBBPZPEBZLII-UHFFFAOYSA-N, BBL103271, MFCD11054110, STL557081, ZINC67172961, AKOS015841218, CS-W001523, RP07276, KS-000004V6, AM100618, AS-50767, SY098607, Butyl 4,4-difluoro-1-piperidinecarboxylate, TC-063425, FT-0684984, Y8550, MFCD11054110 (95%), J-524664, F1907-0037, 4,4-Difluoropiperidine-1-carboxylic acid tert-butyl ester, 157561-99-4,

Complexity	238
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.123g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	221.248g/mol
Monoisotopic Mass	221.123g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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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