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2,5-Dichlorotoluene - 98%, high purity , CAS No.19398-61-9

1 Citations

COA

Grade & Purity:

≥98%

Cas Number: 19398-61-9
Molecular Weight: 161.03
Beilstein Registry Number: 1859112
EC Number: 243-032-2
MDL number: MFCD00000609
PubChem CID: 29572
PubChem SID: 488183103

In stock

Item Number

D113533

Grouped product items
SKU	Size	Availability	Price
D113533-5g	5g	8	$17.90
D113533-25g	25g	8	$48.90
D113533-100g	100g	3	$174.90

View related series

Aryl halides (excluding fluorides) (243) Non heterocyclic block (8163)

Basic Description

Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Halobenzenes
      - Level5 Chlorobenzenes
        Level6 Dichlorobenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Halobenzenes
Intermediate Tree Nodes	Chlorobenzenes
Direct Parent	Dichlorobenzenes
Alternative Parents	Toluenes Aryl chlorides Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	1,4-dichlorobenzene - Toluene - Aryl halide - Aryl chloride - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
External Descriptors	a chloroaromatic compound
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	488183103
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488183103
IUPAC Name	1,4-dichloro-2-methylbenzene
INCHI	InChI=1S/C7H6Cl2/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H3
InChIKey	KFAKZJUYBOYVKA-UHFFFAOYSA-N
Smiles	CC1=C(C=CC(=C1)Cl)Cl
Isomeric SMILES	CC1=C(C=CC(=C1)Cl)Cl
WGK Germany	3
UN Number	2238
Molecular Weight	161.03
Beilstein	1859112
Reaxy-Rn	1859112
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1859112&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.

6 results found

Lot Number	Certificate Type	Date	Item
G1206026	Certificate of Analysis	Apr 07, 2024	D113533
D2301821	Certificate of Analysis	Apr 19, 2023	D113533
C2308595	Certificate of Analysis	Mar 13, 2023	D113533
E1922115	Certificate of Analysis	Mar 09, 2023	D113533
C1820141	Certificate of Analysis	Jan 25, 2022	D113533
D2301822	Certificate of Analysis	Jan 25, 2022	D113533

Chemical and Physical Properties

Refractive Index	1.546-1.548
Flash Point(°F)	79℃
Flash Point(°C)	79℃
Boil Point(°C)	197-200°C
Melt Point(°C)	4-5°C
Molecular Weight	161.030 g/mol
XLogP3	4.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	159.985 Da
Monoisotopic Mass	159.985 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	92.900
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

Citations of This Product

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