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1-Allyl-3-bromo-5-fluorobenzene - 95%, high purity , CAS No.868860-65-5

COA

Grade & Purity:

≥95%

Cas Number: 868860-65-5
Molecular Weight: 215.06
PubChem CID: 69446193

In stock

Item Number

A195435

Grouped product items
SKU	Size	Availability	Price	Qty
A195435-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$365.90
A195435-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$875.90

Discover 1-Allyl-3-bromo-5-fluorobenzene by Aladdin Scientific in 95% for only $365.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	1-Allyl-3-bromo-5-fluorobenzene \| 868860-65-5 \| 1-bromo-3-fluoro-5-prop-2-enylbenzene \| SCHEMBL5449546 \| AKOS026674287 \| DS-9852 \| 3-(3-Bromo-5-fluorophenyl)-1-propene \| CS-0456690 \| C76836
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Halobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Fluorobenzenes
Alternative Parents	Bromobenzenes Aryl fluorides Aryl bromides Organofluorides Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Fluorobenzene - Bromobenzene - Aryl halide - Aryl fluoride - Aryl bromide - Hydrocarbon derivative - Organofluoride - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to 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-bromo-3-fluoro-5-prop-2-enylbenzene
INCHI	InChI=1S/C9H8BrF/c1-2-3-7-4-8(10)6-9(11)5-7/h2,4-6H,1,3H2
InChIKey	RICOTNMALOCCKV-UHFFFAOYSA-N
Smiles	C=CCC1=CC(=CC(=C1)Br)F
Isomeric SMILES	C=CCC1=CC(=CC(=C1)Br)F
Molecular Weight	215.06
Reaxy-Rn	51302738
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=51302738&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	215.060 g/mol
XLogP3	3.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	213.979 Da
Monoisotopic Mass	213.979 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	136.000
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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