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4-Bromo-2,2-difluoro-1,3-benzodioxole - 96%, high purity , CAS No.144584-66-7

COA

Grade & Purity:

≥96%

Cas Number: 144584-66-7
Molecular Weight: 237
MDL number: MFCD01631385
PubChem CID: 2773297
PubChem SID: 488193456

In stock

Item Number

B167315

Grouped product items
SKU	Size	Availability	Price	Qty
B167315-1g	1g	5	$52.90
B167315-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$167.90

Discover 4-Bromo-2,2-difluoro-1,3-benzodioxole by Aladdin Scientific in 96% for only $52.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	4-bromo-2,2-difluoro-1,3-dioxaindane \| 4-Bromo-2,2-difluoro-1,3-benzodioxole, 96% \| 4-bromo-2,2-difluoro-1,3-benzodioxolane \| SCHEMBL978248 \| 4-BROMO-2,2-DIFLUORO-2H-1,3-BENZODIOXOLE \| BBL100752 \| EN300-111919 \| FT-0617727 \| PB14251 \| 2,2-DIFLUORO-4-BROMO
Specifications & Purity	≥96%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzodioxoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzodioxoles
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzodioxoles
Alternative Parents	Benzenoids Aryl bromides Oxacyclic compounds Organooxygen compounds Organofluorides Organobromides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzodioxole - Benzenoid - Aryl halide - Aryl bromide - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organobromide - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
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

Pubchem Sid	488193456
IUPAC Name	4-bromo-2,2-difluoro-1,3-benzodioxole
INCHI	InChI=1S/C7H3BrF2O2/c8-4-2-1-3-5-6(4)12-7(9,10)11-5/h1-3H
InChIKey	LSZYHXNOLVSZHH-UHFFFAOYSA-N
Smiles	C1=CC2=C(C(=C1)Br)OC(O2)(F)F
Isomeric SMILES	C1=CC2=C(C(=C1)Br)OC(O2)(F)F
WGK Germany	1
Molecular Weight	237
Reaxy-Rn	9388335
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9388335&ln=

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.

2 results found

Lot Number	Certificate Type	Date	Item
L1911214	Certificate of Analysis	Jul 19, 2023	B167315
E2331075	Certificate of Analysis	Jun 09, 2023	B167315

Chemical and Physical Properties

Solubility	Slightly soluble in water.
Sensitivity	heat sensitive
Flash Point(°F)	194 °F
Flash Point(°C)	90 °C
Molecular Weight	237.000 g/mol
XLogP3	3.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	235.928 Da
Monoisotopic Mass	235.928 Da
Topological Polar Surface Area	18.500 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	188.000
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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