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2,2-Dichloro-1,3-benzodioxole - 97%, high purity , CAS No.2032-75-9

COA

Grade & Purity:

≥97%

Cas Number: 2032-75-9
Molecular Weight: 191.01
MDL number: MFCD00196818
PubChem CID: 11041568

In stock

Item Number

D137513

Grouped product items
SKU	Size	Availability	Price	Qty
D137513-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$893.90

Basic Description

Synonyms	2,2-DICHLORO-1,3-BENZODIOXOLE \| 2032-75-9 \| 2,2-dichlorobenzo[d][1,3]dioxole \| MFCD00196818 \| 2,2-dichloro-1,3-benzodioxol \| 1,3-Benzodioxole,2,2-dichloro- \| EC 426-850-6 \| SCHEMBL1003323 \| DTXSID70452991 \| NMNKOUVBELKKTR-UHFFFAOYSA-N \| 2,2-Dichloro-benzo[1,3]dioxole \| 1,3-Ben
Specifications & Purity	≥97%
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 Oxacyclic compounds Organooxygen compounds Organochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzodioxole - Benzenoid - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - 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

IUPAC Name	2,2-dichloro-1,3-benzodioxole
INCHI	InChI=1S/C7H4Cl2O2/c8-7(9)10-5-3-1-2-4-6(5)11-7/h1-4H
InChIKey	NMNKOUVBELKKTR-UHFFFAOYSA-N
Smiles	C1=CC=C2C(=C1)OC(O2)(Cl)Cl
Isomeric SMILES	C1=CC=C2C(=C1)OC(O2)(Cl)Cl
Molecular Weight	191.01
Reaxy-Rn	121272
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=121272&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	191.010 g/mol
XLogP3	3.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	189.959 Da
Monoisotopic Mass	189.959 Da
Topological Polar Surface Area	18.500 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	145.000
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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