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1-(4-Bromobutoxy)-4-Chlorobenzene - 95%, high purity , CAS No.2033-81-0

COA

Grade & Purity:

≥95%

Cas Number: 2033-81-0
Molecular Weight: 263.57
PubChem CID: 2734934

In stock

Item Number

B301601

Grouped product items
SKU	Size	Availability	Price
B301601-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$206.90
B301601-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$756.90
B301601-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,019.90

Basic Description

Synonyms	1-(4-bromobutoxy)-4-chlorobenzene \| 2033-81-0 \| 1-(4-BROMO-BUTOXY)-4-CHLORO-BENZENE \| Benzene, 1-(4-bromobutoxy)-4-chloro- \| MFCD02030563 \| SCHEMBL1172364 \| DTXSID50370583 \| DPTVPYBSBNIACI-UHFFFAOYSA-N \| BCP33983 \| CAA03381 \| 1-(4-Bromo-butoxy)-4-chlorobenzene \| AKOS000301915 \|
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenol ethers

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenol ethers
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenol ethers
Alternative Parents	Phenoxy compounds Chlorobenzenes Alkyl aryl ethers Aryl chlorides Organochlorides Organobromides Hydrocarbon derivatives Alkyl bromides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenoxy compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Ether - Organooxygen compound - Hydrocarbon derivative - Alkyl halide - Alkyl bromide - Organic oxygen compound - Organohalogen compound - Organobromide - Organochloride - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
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	1-(4-bromobutoxy)-4-chlorobenzene
INCHI	InChI=1S/C10H12BrClO/c11-7-1-2-8-13-10-5-3-9(12)4-6-10/h3-6H,1-2,7-8H2
InChIKey	DPTVPYBSBNIACI-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1OCCCCBr)Cl
Isomeric SMILES	C1=CC(=CC=C1OCCCCBr)Cl
Molecular Weight	263.57
Reaxy-Rn	1425068
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1425068&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Melt Point(°C)	30-35°C
Molecular Weight	263.560 g/mol
XLogP3	4.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Exact Mass	261.976 Da
Monoisotopic Mass	261.976 Da
Topological Polar Surface Area	9.200 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	124.000
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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