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1-Bromo-3-(methoxymethyl)benzene - 98%, high purity , CAS No.1515-89-5

COA

Grade & Purity:

≥98%

Cas Number: 1515-89-5
Molecular Weight: 201.1
PubChem CID: 13219582

In stock

Item Number

B181672

Grouped product items
SKU	Size	Availability	Price
B181672-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$41.90
B181672-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$170.90
B181672-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$712.90

Basic Description

Synonyms	1-BROMO-3-(METHOXYMETHYL)BENZENE \| 1515-89-5 \| 3-bromobenzyl methyl ether \| Benzene, 1-bromo-3-(methoxymethyl)- \| MFCD11504955 \| meta-Bromobenzyl methyl ether \| SCHEMBL514760 \| 1-Bromo-3-Methoxymethylbenzene \| 1-Bromo-3-methoxymethyl-benzene \| DTXSID80529300 \| 3-Bromobenzyl
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzylethers

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzylethers
Intermediate Tree Nodes	Not available
Direct Parent	Benzylethers
Alternative Parents	Bromobenzenes Aryl bromides Dialkyl ethers Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzylether - Halobenzene - Bromobenzene - Aryl halide - Aryl bromide - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene).
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-bromo-3-(methoxymethyl)benzene
INCHI	InChI=1S/C8H9BrO/c1-10-6-7-3-2-4-8(9)5-7/h2-5H,6H2,1H3
InChIKey	BZYGFMKYRKQSQG-UHFFFAOYSA-N
Smiles	COCC1=CC(=CC=C1)Br
Isomeric SMILES	COCC1=CC(=CC=C1)Br
Molecular Weight	201.1
Reaxy-Rn	2553754
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2553754&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	201.060 g/mol
XLogP3	2.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	199.984 Da
Monoisotopic Mass	199.984 Da
Topological Polar Surface Area	9.200 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	95.300
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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