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5-Bromo-2-(cyclohexylthio)pyrimidine - 98%, high purity , CAS No.1242336-56-6

COA

Grade & Purity:

≥98%

Cas Number: 1242336-56-6
Molecular Weight: 273.2
PubChem CID: 53217406

In stock

Item Number

B180511

Grouped product items
SKU	Size	Availability	Price	Qty
B180511-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,106.90
B180511-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,885.90

Discover 5-Bromo-2-(cyclohexylthio)pyrimidine by Aladdin Scientific in 98% for only $1,106.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	5-Bromo-2-(cyclohexylthio)pyrimidine \| 1242336-56-6 \| 5-bromo-2-cyclohexylsulfanylpyrimidine \| DTXSID20682448 \| MFCD16660317 \| AKOS013181844 \| SB58484 \| 5-Bromo-2-(cyclohexylsulfanyl)pyrimidine \| BS-19606 \| Pyrimidine, 5-bromo-2-(cyclohexylthio)- \| CS-0208515
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organosulfur compounds
  - Class Thioethers
    - Subclass Aryl thioethers

Kingdom	Organic compounds
Superclass	Organosulfur compounds
Class	Thioethers
Subclass	Aryl thioethers
Intermediate Tree Nodes	Not available
Direct Parent	Aryl thioethers
Alternative Parents	Halopyrimidines Alkylarylthioethers Aryl bromides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Aryl thioether - Halopyrimidine - Alkylarylthioether - Aryl bromide - Aryl halide - Pyrimidine - Heteroaromatic compound - Azacycle - Sulfenyl compound - Organoheterocyclic compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.
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	5-bromo-2-cyclohexylsulfanylpyrimidine
INCHI	InChI=1S/C10H13BrN2S/c11-8-6-12-10(13-7-8)14-9-4-2-1-3-5-9/h6-7,9H,1-5H2
InChIKey	LWKBPXULGUZFPU-UHFFFAOYSA-N
Smiles	C1CCC(CC1)SC2=NC=C(C=N2)Br
Isomeric SMILES	C1CCC(CC1)SC2=NC=C(C=N2)Br
PubChem CID	53217406
Molecular Weight	273.2

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	273.190 g/mol
XLogP3	3.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	271.998 Da
Monoisotopic Mass	271.998 Da
Topological Polar Surface Area	51.100 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	166.000
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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