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tert-butyl 3-sulfanylazetidine-1-carboxylate - 97%, high purity , CAS No.941585-25-7

COA

Grade & Purity:

≥97%

Cas Number: 941585-25-7
Molecular Weight: 189.275
PubChem CID: 58513580

In stock

Item Number

T178366

Grouped product items
SKU	Size	Availability	Price
T178366-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$17.90
T178366-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$57.90
T178366-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$257.90
T178366-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,158.90

Discover tert-butyl 3-sulfanylazetidine-1-carboxylate by Aladdin Scientific in 97% for only $17.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	941585-25-7 \| 1-BOC-3-MERCAPTO-AZETIDINE \| tert-butyl 3-mercaptoazetidine-1-carboxylate \| TERT-BUTYL 3-SULFANYLAZETIDINE-1-CARBOXYLATE \| MFCD01861743 \| N-Boc-3-mercaptoazetidine \| 1-Boc-3-mercaptoazetidine \| SCHEMBL970631 \| DTXSID50729350 \| GUZYDTTYVXLGCV-UHFFFAOYSA-N \| AKOS
Specifications & Purity	≥97%
Storage Temp	Room temperature
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 Alkylthiols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Azetidinecarboxylic acid - Carbamic acid ester - Tertiary amine - Azacycle - Alkylthiol - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - 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-sulfanylazetidine-1-carboxylate
INCHI	InChI=1S/C8H15NO2S/c1-8(2,3)11-7(10)9-4-6(12)5-9/h6,12H,4-5H2,1-3H3
InChIKey	GUZYDTTYVXLGCV-UHFFFAOYSA-N
Smiles	CC(C)(C)OC(=O)N1CC(C1)S
Isomeric SMILES	CC(C)(C)OC(=O)N1CC(C1)S
PubChem CID	58513580
Molecular Weight	189.275

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	189.280 g/mol
XLogP3	1.200
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	189.082 Da
Monoisotopic Mass	189.082 Da
Topological Polar Surface Area	30.500 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	182.000
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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