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tert-butyl N-[1-[(3R)-pyrrolidin-3-yl]cyclopropyl]carbamate - 97%, high purity , CAS No.431058-52-5

COA

Grade & Purity:

≥97%

Cas Number: 431058-52-5
MDL number: MFCD27922176
PubChem CID: 11117758

In stock

Item Number

T633886

Grouped product items
SKU	Size	Availability	Price
T633886-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$387.90
T633886-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$484.90
T633886-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,454.90
T633886-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,717.90

Basic Description

Synonyms	431058-52-5 \| (R)-TERT-BUTYL (1-(PYRROLIDIN-3-YL)CYCLOPROPYL)CARBAMATE \| Tert-butyl N-[1-[(3R)-pyrrolidin-3-yl]cyclopropyl]carbamate \| TERT-BUTYL N-{1-[(3R)-PYRROLIDIN-3-YL]CYCLOPROPYL}CARBAMATE \| Carbamic acid, [1-(3R)-3-pyrrolidinylcyclopropyl]-, 1,1-di
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyrrolidines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyrrolidines
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Pyrrolidines
Alternative Parents	Carbamate esters Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Carbamic acid ester - Pyrrolidine - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as pyrrolidines. These are compounds containing a pyrrolidine ring, which is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four 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-[1-[(3R)-pyrrolidin-3-yl]cyclopropyl]carbamate
INCHI	InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-12(5-6-12)9-4-7-13-8-9/h9,13H,4-8H2,1-3H3,(H,14,15)/t9-/m1/s1
InChIKey	QJTCVIHNVLALCL-SECBINFHSA-N
Smiles	CC(C)(C)OC(=O)NC1(CC1)C2CCNC2
Isomeric SMILES	CC(C)(C)OC(=O)NC1(CC1)[C@@H]2CCNC2
PubChem CID	11117758

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	226.320 g/mol
XLogP3	1.300
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	226.168 Da
Monoisotopic Mass	226.168 Da
Topological Polar Surface Area	50.400 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	279.000
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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