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tert-butyl 3-(2-aminoethyl)azetidine-1-carboxylate - 97%, high purity , CAS No.898271-20-0

COA

Grade & Purity:

≥97%

Cas Number: 898271-20-0
Molecular Weight: 200.28
EC Number: 802-189-2
MDL number: MFCD09878606
PubChem CID: 44630603

In stock

Item Number

T635022

Grouped product items
SKU	Size	Availability	Price
T635022-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$94.90
T635022-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$284.90
T635022-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$474.90

Basic Description

Synonyms	AKOS005258723 \| MFCD09878606 \| PB17680 \| 1-Boc-(3-Aminoethyl)azetidine \| 1-Boc-3-(2-aminoethyl)azetidine \| tert-Butyl 3-(2-aminoethyl)azetidine-1-carboxylate \| YKB27120 \| FT-0648210 \| tert-butyl 3-(2-aminoethyl)-1-azetidinecarboxylate \| AM20120298 \| F8887
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azetidines
    - Subclass Azetidinecarboxylic acids or derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azetidines
Subclass	Azetidinecarboxylic acids or derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Azetidinecarboxylic acids
Alternative Parents	Carbamate esters Tertiary amines Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Azetidinecarboxylic acid - Carbamic acid ester - Tertiary amine - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as azetidinecarboxylic acids. These are organic compounds containing a carboxylic acid group attached to an azetidine ring.
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 3-(2-aminoethyl)azetidine-1-carboxylate
INCHI	InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-6-8(7-12)4-5-11/h8H,4-7,11H2,1-3H3
InChIKey	XQNQFOKZUQWWDO-UHFFFAOYSA-N
Smiles	CC(C)(C)OC(=O)N1CC(C1)CCN
Isomeric SMILES	CC(C)(C)OC(=O)N1CC(C1)CCN
Alternate CAS	898271-20-0
PubChem CID	44630603
Molecular Weight	200.28

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	200.280 g/mol
XLogP3	0.600
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	200.152 Da
Monoisotopic Mass	200.152 Da
Topological Polar Surface Area	55.600 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	205.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
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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