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cis-6-Oxo-7-oxa-5-azaspiro[3.4]octane-2-carboxylic acid - 97%, high purity , CAS No.2135785-62-3

COA

Grade & Purity:

≥97%

Cas Number: 2135785-62-3
Molecular Weight: 171.15
EC Number: ‘853-061-8
PubChem CID: 130475907

In stock

Item Number

C588119

Grouped product items
SKU	Size	Availability	Price
C588119-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$54.90
C588119-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$112.90
C588119-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$373.90

View related series

Nitrogen mixed snail (1) Nitrogenous compounds (2445) Spiral ring (6)

Basic Description

Synonyms	AC-37162 \| EN300-7447186 \| 2402831-35-8 \| (cis)-6-oxo-7-oxa-5-azaspiro[3.4]octane-2-carboxylic acid \| 6-Oxo-7-oxa-5-azaspiro[3.4]octane-2-carboxylic acid \| cis-6-Oxo-7-oxa-5-azaspiro[3.4]octane-2-carboxylic acid \| (2s,4s)-6-oxo-7-oxa-5-azaspiro[3.4]octane
Specifications & Purity	≥97%
Storage Temp	Protected from light,Store at -20°C,Desiccated
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Fatty Acyls
    - Subclass Fatty acids and conjugates

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Class	Fatty Acyls
Subclass	Fatty acids and conjugates
Intermediate Tree Nodes	Not available
Direct Parent	Heterocyclic fatty acids
Alternative Parents	Branched fatty acids Oxazolidinones Carbamate esters Organic carbonic acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteropolycyclic compounds
Substituents	Heterocyclic fatty acid - Branched fatty acid - Oxazolidinone - Carbamic acid ester - Oxazolidine - Carbonic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aliphatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as heterocyclic fatty acids. These are fatty acids containing a heterocyclic attached to the acyl chain.
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	6-oxo-7-oxa-5-azaspiro[3.4]octane-2-carboxylic acid
INCHI	InChI=1S/C7H9NO4/c9-5(10)4-1-7(2-4)3-12-6(11)8-7/h4H,1-3H2,(H,8,11)(H,9,10)
InChIKey	IGXPOTLWCQJQJQ-UHFFFAOYSA-N
Smiles	C1C(CC12COC(=O)N2)C(=O)O
Isomeric SMILES	C1C(CC12COC(=O)N2)C(=O)O
Molecular Weight	171.15
Reaxy-Rn	31787674
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=31787674&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	171.150 g/mol
XLogP3	-0.400
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	171.053 Da
Monoisotopic Mass	171.053 Da
Topological Polar Surface Area	75.600 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	244.000
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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