AG001549

1215071-23-0 | Carbamic acid, N-(3,3-difluorocyclopentyl)-, 1,1-dimethylethyl ester

AG001549

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CAS Number	1215071-23-0
Catalog Number	AG001549(AGN-PC-0WD0H4)
Chemical Name	Carbamic acid, N-(3,3-difluorocyclopentyl)-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl N-(3,3-difluorocyclopentyl)carbamate
InChI	InChI=1S/C10H17F2NO2/c1-9(2,3)15-8(14)13-7-4-5-10(11,12)6-7/h7H,4-6H2,1-3H3,(H,13,14)
InChI Key	SCXQXMBCRMLPGO-UHFFFAOYSA-N
MDL Number	MFCD16657108
Molecular Formula	C10H17F2NO2
Molecular Weight	221.2443
SMILES	O=C(OC(C)(C)C)NC1CC(F)(F)CC1
Synonyms	1215071-23-0, tert-Butyl (3,3-difluorocyclopentyl)carbamate, TERT-BUTYL 3,3-DIFLUOROCYCLOPENTYLCARBAMATE, N-Boc-3,3-difluorocyclopentanamine, N-t-BOC-3,3-Difluorocyclopentylamine, SCHEMBL1951353, SCXQXMBCRMLPGO-UHFFFAOYSA-N, MFCD16657108, AKOS022182887, AS-30341, QC-11504, SC-66463, SY038556, ST24049495, MFCD16657108 (95%), tert-butyl N-(3,3-difluorocyclopentyl)carbamate, N-t-BOC-3,3-Difluorocyclopentylamine, AldrichCPR,

Complexity	248
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	1
Isotope Atom Count	0
Molecular Weight	221.248g/mol
Monoisotopic Mass	221.123g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precautionary statements	P261-P305+P351+P338

Certificate of Analysis

Lot Number