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3-Bromoadamantane-1-carboxylic acid - 97%, high purity , CAS No.21816-08-0

COA

Grade & Purity:

≥97%

Cas Number: 21816-08-0
Molecular Weight: 259.14
MDL number: MFCD00167820
PubChem CID: 30818
PubChem SID: 504753416

In stock

Item Number

W132082

Grouped product items
SKU	Size	Availability	Price
W132082-200mg	200mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$17.90
W132082-1g	1g	3	$69.90
W132082-5g	5g	3	$310.90
W132082-25g	25g	3	$1,398.90
W132082-100g	100g	2	$5,034.90

Basic Description

Synonyms	SCHEMBL131414 \| 1-Bromoadamantane-3-carboxylic acid \| CCG-247256 \| HMS557G02 \| Z56757155 \| BBL033826 \| F0035-0448 \| Tricyclo[3.3.1.13,7]decane-1-carboxylic acid, 3-bromo- \| AKOS000114514 \| W-201896 \| Maybridge1_005590 \| SY018895 \| 3-bromoadamantane-1-carb
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

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 Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl bromide - 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

Pubchem Sid	504753416
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504753416
IUPAC Name	3-bromoadamantane-1-carboxylic acid
INCHI	InChI=1S/C11H15BrO2/c12-11-4-7-1-8(5-11)3-10(2-7,6-11)9(13)14/h7-8H,1-6H2,(H,13,14)
InChIKey	DJUDQBVINJIMFO-UHFFFAOYSA-N
Smiles	C1C2CC3(CC1CC(C2)(C3)Br)C(=O)O
Isomeric SMILES	C1C2CC3(CC1CC(C2)(C3)Br)C(=O)O
WGK Germany	3
RTECS	AU4452500
PubChem CID	30818
Molecular Weight	259.14

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number	Certificate Type	Date	Item
A2212223	Certificate of Analysis	Jul 09, 2025	W132082
A2212221	Certificate of Analysis	Jul 09, 2025	W132082
A2212224	Certificate of Analysis	Jul 09, 2025	W132082
L2413714	Certificate of Analysis	Apr 10, 2024	W132082
L2413716	Certificate of Analysis	Apr 10, 2024	W132082
K1928118	Certificate of Analysis	Jul 17, 2023	W132082

Chemical and Physical Properties

Melt Point(°C)	146-150℃
Molecular Weight	259.140 g/mol
XLogP3	2.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	258.026 Da
Monoisotopic Mass	258.026 Da
Topological Polar Surface Area	37.300 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	286.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
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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