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methyl 4-hydroxybicyclo[2.2.2]octane-1-carboxylate - 97%, high purity

COA

Grade & Purity:

≥97%

PubChem CID: 12560142

In stock

Item Number

M175827

Grouped product items
SKU	Size	Availability	Price	Qty
M175827-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$133.90
M175827-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$444.90

Discover methyl 4-hydroxybicyclo[2.2.2]octane-1-carboxylate by Aladdin Scientific in 97% for only $133.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	methyl 4-hydroxybicyclo[2.2.2]octane-1-carboxylate \| 23062-53-5 \| Bicyclo[2.2.2]octane-1-carboxylic acid, 4-hydroxy-, methyl ester \| MFCD22689519 \| SCHEMBL5930909 \| DTXSID10502565 \| LUBWUSMZFMBOIQ-UHFFFAOYSA-N \| AMY19122 \| AKOS025243495 \| SB12636 \| AC-31329 \| AS-53591 \| SY028308
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Alcohols and polyols

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Alcohols and polyols
Intermediate Tree Nodes	Not available
Direct Parent	Tertiary alcohols
Alternative Parents	Methyl esters Cyclic alcohols and derivatives Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	Methyl ester - Tertiary alcohol - Cyclic alcohol - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Carbonyl group - Aliphatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as tertiary alcohols. These are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ).
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	methyl 4-hydroxybicyclo[2.2.2]octane-1-carboxylate
INCHI	InChI=1S/C10H16O3/c1-13-8(11)9-2-5-10(12,6-3-9)7-4-9/h12H,2-7H2,1H3
InChIKey	LUBWUSMZFMBOIQ-UHFFFAOYSA-N
Smiles	COC(=O)C12CCC(CC1)(CC2)O

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	184.230 g/mol
XLogP3	0.800
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	184.11 Da
Monoisotopic Mass	184.11 Da
Topological Polar Surface Area	46.500 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	210.000
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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