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4-bromocyclohexan-1-one - 97%, high purity , CAS No.22460-52-2

COA

Grade & Purity:

≥97%

Cas Number: 22460-52-2
Molecular Weight: 177.04
EC Number: 855-838-7
PubChem CID: 11401088

In stock

Item Number

B632418

Grouped product items
SKU	Size	Availability	Price	Qty
B632418-250mg	250mg	2	$349.90
B632418-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$979.90

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Cyclohexane compounds (40)

Basic Description

Synonyms	DTXSID00464683 \| OMCGWSBEIHGWOH-UHFFFAOYSA-N \| PS-15546 \| mono-bromocyclohexanone \| SY275581 \| 4-Bromocyclohexanone \| 4-bromocyclohexan-1-one \| XAA46052 \| AKOS026730019 \| Cyclohexanone, 4-bromo- \| EN300-139262 \| MFCD20621393 \| SCHEMBL3839916 \| C77503
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 oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds
      - Level5 Ketones
        Level6 Cyclic ketones

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Carbonyl compounds
Intermediate Tree Nodes	Ketones
Direct Parent	Cyclic ketones
Alternative Parents	Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Cyclic ketone - Organic oxide - Hydrocarbon derivative - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as cyclic ketones. These are organic compounds containing a ketone that is conjugated to a cyclic moiety.
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-bromocyclohexan-1-one
INCHI	InChI=1S/C6H9BrO/c7-5-1-3-6(8)4-2-5/h5H,1-4H2
InChIKey	OMCGWSBEIHGWOH-UHFFFAOYSA-N
Smiles	C1CC(=O)CCC1Br
Isomeric SMILES	C1CC(=O)CCC1Br
Alternate CAS	22460-52-2
PubChem CID	11401088
Molecular Weight	177.04

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.

4 results found

Lot Number	Certificate Type	Date	Item
D2517315	Certificate of Analysis	Apr 10, 2025	B632418
D2517317	Certificate of Analysis	Apr 10, 2025	B632418
D2517314	Certificate of Analysis	Apr 10, 2025	B632418
D2517316	Certificate of Analysis	Apr 10, 2025	B632418

Chemical and Physical Properties

Molecular Weight	177.040 g/mol
XLogP3	1.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	175.984 Da
Monoisotopic Mass	175.984 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	90.700
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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