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Bicyclo[2.2.1]heptane-2-carboxylic acid - 96%, high purity , CAS No.824-62-4

COA

Grade & Purity:

≥96%

Cas Number: 824-62-4
Molecular Weight: 140.18
EC Number: 212-532-2,621-576-5,878-973-3
PubChem CID: 79113
PubChem SID: 504755347

In stock

Item Number

B590261

Grouped product items
SKU	Size	Availability	Price
B590261-1g	1g	3	$9.90
B590261-5g	5g	3	$35.90
B590261-25g	25g	2	$141.90

Basic Description

Synonyms	Bicyclo[2.2.1]heptane-2-carboxylic acid, endo- \| AKOS016874856 \| Z147433488 \| (1R,2R,4S)-bicyclo[2.2.1]heptane-2-carboxylic acid \| AB86378 \| (2S)-Norbornane-2-carboxylicacid \| 5-[(3aS,4S,6aR)-2,5-dioxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pen
Specifications & Purity	≥96%
Storage Temp	Room temperature,Desiccated
Shipped In	Normal
Product Description	Product Application: Norbornane-2-carboxylic acid is used in the preparation of 2-Bromonorbornane-1-carboxylic acid. It is also used as Pharmaceutical intermediates.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Prenol lipids
    - Subclass Monoterpenoids

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Class	Prenol lipids
Subclass	Monoterpenoids
Intermediate Tree Nodes	Not available
Direct Parent	Bicyclic monoterpenoids
Alternative Parents	Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	Bicyclic monoterpenoid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
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

Pubchem Sid	504755347
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504755347
IUPAC Name	bicyclo[2.2.1]heptane-2-carboxylic acid
INCHI	InChI=1S/C8H12O2/c9-8(10)7-4-5-1-2-6(7)3-5/h5-7H,1-4H2,(H,9,10)
InChIKey	JESWDXIHOJGWBP-UHFFFAOYSA-N
Smiles	C1CC2CC1CC2C(=O)O
Isomeric SMILES	C1CC2CC1CC2C(=O)O
Alternate CAS	934-29-2,934-28-1,824-62-4
NSC Number	152331
Molecular Weight	140.18
Reaxy-Rn	2042631
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2042631&ln=

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

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

Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
K2310152	Certificate of Analysis	Sep 25, 2023	B590261
K2310159	Certificate of Analysis	Sep 25, 2023	B590261
K2310162	Certificate of Analysis	Sep 25, 2023	B590261
K2310156	Certificate of Analysis	Sep 25, 2023	B590261
K2310171	Certificate of Analysis	Sep 25, 2023	B590261
K2310157	Certificate of Analysis	Sep 25, 2023	B590261
K2310204	Certificate of Analysis	Sep 25, 2023	B590261

Chemical and Physical Properties

Solubility	Insoluble in water.
Refractive Index	1.4855
Flash Point(°F)	>212°F
Flash Point(°C)	>100℃
Boil Point(°C)	134-136℃/16mm
Melt Point(°C)	ca 40℃
Molecular Weight	140.180 g/mol
XLogP3	1.800
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	140.084 Da
Monoisotopic Mass	140.084 Da
Topological Polar Surface Area	37.300 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	165.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	3
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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