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tert-butyl (2S,3R)-3-hydroxy-2-methylazetidine-1-carboxylate - 97%, high purity , CAS No.172017-35-5

COA

Grade & Purity:

≥97%

Cas Number: 172017-35-5
Molecular Weight: 187.24
MDL number: MFCD27987701
PubChem CID: 99770590

In stock

Item Number

T630268

Grouped product items
SKU	Size	Availability	Price
T630268-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$110.90
T630268-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$154.90
T630268-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$220.90
T630268-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$662.90
T630268-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,104.90
T630268-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,209.90

Basic Description

Synonyms	172017-35-5 \| tert-Butyl (2S,3R)-3-hydroxy-2-methylazetidine-1-carboxylate \| tert-butyl(2S,3R)-3-hydroxy-2-methylazetidine-1-carboxylate \| (2S,3R)-1-Boc-3-hydroxy-2-methylazetidine \| MFCD27987701 \| SCHEMBL23537846 \| trans-1-Boc-3-hydroxy-2-methylazetidine
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 Secondary alcohols Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Azetidinecarboxylic acid - Carbamic acid ester - Secondary alcohol - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - 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 (2S,3R)-3-hydroxy-2-methylazetidine-1-carboxylate
INCHI	InChI=1S/C9H17NO3/c1-6-7(11)5-10(6)8(12)13-9(2,3)4/h6-7,11H,5H2,1-4H3/t6-,7+/m0/s1
InChIKey	OBLFUJCDADLZAJ-NKWVEPMBSA-N
Smiles	CC1C(CN1C(=O)OC(C)(C)C)O
Isomeric SMILES	C[C@H]1[C@@H](CN1C(=O)OC(C)(C)C)O
PubChem CID	99770590
Molecular Weight	187.24

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	187.240 g/mol
XLogP3	0.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	187.121 Da
Monoisotopic Mass	187.121 Da
Topological Polar Surface Area	49.800 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	209.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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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