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4-(Hydroxymethyl)bicyclo[2.2.2]octane-1-carboxylic acid - 97%, high purity , CAS No.828-52-4

COA

Grade & Purity:

≥97%

Cas Number: 828-52-4
Molecular Weight: 184.23
PubChem CID: 301131

In stock

Item Number

H195205

Grouped product items
SKU	Size	Availability	Price	Qty
H195205-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$47.90
H195205-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$157.90

Discover 4-(Hydroxymethyl)bicyclo[2.2.2]octane-1-carboxylic acid by Aladdin Scientific in 97% for only $47.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	4-(Hydroxymethyl)bicyclo[2.2.2]octane-1-carboxylic acid \| 828-52-4 \| 4-(Hydroxymethyl)bicyclo(2.2.2)octane-1-carboxylic acid \| NSC177415 \| 4-(Hydroxymethyl)bicyclo[2.2.2]octane-1-carboxylicacid \| SCHEMBL20944070 \| DTXSID00306539 \| CPVMAYNPSFMOGK-UHFFFAOYSA-N \| MFCD206402
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Carboxylic acids

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Carboxylic acids
Intermediate Tree Nodes	Not available
Direct Parent	Carboxylic acids
Alternative Parents	Monocarboxylic acids and derivatives Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as carboxylic acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH.
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	4-(hydroxymethyl)bicyclo[2.2.2]octane-1-carboxylic acid
INCHI	InChI=1S/C10H16O3/c11-7-9-1-4-10(5-2-9,6-3-9)8(12)13/h11H,1-7H2,(H,12,13)
InChIKey	CPVMAYNPSFMOGK-UHFFFAOYSA-N
Smiles	C1CC2(CCC1(CC2)CO)C(=O)O
Isomeric SMILES	C1CC2(CCC1(CC2)CO)C(=O)O
Molecular Weight	184.23
Reaxy-Rn	2966960
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2966960&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	184.230 g/mol
XLogP3	0.700
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	184.11 Da
Monoisotopic Mass	184.11 Da
Topological Polar Surface Area	57.500 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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