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tert-butyl N-[(3R)-4,4-difluoropiperidin-3-yl]carbamate - 97%, high purity , CAS No.2089321-22-0

COA

Grade & Purity:

≥97%

Cas Number: 2089321-22-0
Molecular Weight: 236.26
PubChem CID: 68184615

In stock

Item Number

T631506

Grouped product items
SKU	Size	Availability	Price
T631506-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$285.90
T631506-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$457.90
T631506-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$762.90
T631506-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,373.90

Basic Description

Synonyms	2089321-22-0 \| tert-butyl N-[(3R)-4,4-difluoropiperidin-3-yl]carbamate \| (R)-tert-butyl (4,4-difluoropiperidin-3-yl)carbamate \| tert-Butyl (R)-(4,4-difluoropiperidin-3-yl)carbamate \| SCHEMBL11978255 \| MFCD30387005 \| BS-43143 \| CS-0091704 \| (3R)-3-(Boc-ami
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Piperidines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Piperidines
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Piperidines
Alternative Parents	Carbamate esters Organic carbonic acids and derivatives Dialkylamines Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Piperidine - Carbamic acid ester - Carbonic acid derivative - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Alkyl halide - Alkyl fluoride - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as piperidines. These are compounds containing a piperidine ring, which is a saturated aliphatic six-member ring with one nitrogen atom and five carbon atoms.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	tert-butyl N-[(3R)-4,4-difluoropiperidin-3-yl]carbamate
INCHI	InChI=1S/C10H18F2N2O2/c1-9(2,3)16-8(15)14-7-6-13-5-4-10(7,11)12/h7,13H,4-6H2,1-3H3,(H,14,15)/t7-/m1/s1
InChIKey	PQJOHBZTOIMHCM-SSDOTTSWSA-N
Smiles	CC(C)(C)OC(=O)NC1CNCCC1(F)F
Isomeric SMILES	CC(C)(C)OC(=O)N[C@@H]1CNCCC1(F)F
PubChem CID	68184615
Molecular Weight	236.26

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	236.260 g/mol
XLogP3	1.400
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	236.134 Da
Monoisotopic Mass	236.134 Da
Topological Polar Surface Area	50.400 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	264.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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