3,4-Dichlorotoluene - analytical standard, for environmental analysis , CAS No.95-75-0

CAS: 95-75-0 Cat. No.: D100627 Molecular Weight: 161.03 Beilstein Registry Number: 1931687 EC Number: 202-447-9
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GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. for Environmental analysis ? Environmental-analysis grade — low background for trace pollutants in water/soil/air. Use in environmental testing where contamination skews trace results.
Synonyms
3,4-DICHLOROTOLUENE|95-75-0|1,2-Dichloro-4-methylbenzene|Benzene, 1,2-dichloro-4-methyl-|Toluene, 3,4-dichloro-|NSC 8765|EINECS 202-447-9|AI3-02581|NSC8765|3,4-dichloro-toluene|EC 202-447-9|3,4-Dichlorotoluene, 97%|CHEMBL47525|SCHEMBL156450|Benzene,2-dich
Storage
Room temperature
Shipped In
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Status
Price
Qty
250mg
D100627-250mg
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$59.90

$69.90
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Why this grade

analytical standard, for environmental analysis Analytical standard,for Environmental analysis for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships FedEx DG Service Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
3, 4-DICHLOROTOLUENE | 95-75-0 | 1, 2-Dichloro-4-methylbenzene | Benzene, 1, 2-dichloro-4-methyl- | Toluene, 3, 4-dichloro- | NSC 8765 | EINECS 202-447-9 | AI3-02581 | NSC8765 | 3, 4-dichloro-toluene | EC 202-447-9 | 3, 4-Dichlorotoluene, 97% | CHEMBL47525 | SCHEMBL156450 | Benzene, 2-dich
Specifications & Purity
analytical standard, for environmental analysis
Storage
Room temperature
Shipped In
FedEx DG Service
This product requires cold chain shipping. Ground and other economy services are not available.
Grade
Analytical standard, for Environmental analysis
Names and Identifiers
Canonical SmilesCC1=CC(=C(C=C1)Cl)Cl
IUPAC Name1,2-dichloro-4-methylbenzene
InChIKeyWYUIWKFIFOJVKW-UHFFFAOYSA-N
INCHI1S/C7H6Cl2/c1-5-2-3-6(8)7(9)4-5/h2-4H,1H3
Isomeric SMILES CC1=CC(=C(C=C1)Cl)Cl
WGK Germany 2
UN Number 3082
Packing Group III
Molecular Weight 161.03
Beilstein 1931687
Reaxy-Rn 1931687
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1931687&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassHalobenzenes
Intermediate Tree Nodes Chlorobenzenes
Direct ParentDichlorobenzenes
Alternative Parents Toluenes  Aryl chlorides  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents 1,2-dichlorobenzene - Toluene - Aryl halide - Aryl chloride - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
DescriptionThis 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
3D Structure
Interactive Chemical Structure Model





Mechanisms of Action
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 NumberCertificate TypeDateItem
J2121239Certificate of AnalysisJul 11, 2023 D100627
F1727017Certificate of AnalysisMay 06, 2023 D100627
Chemical and Physical Properties
Refractive Index1.54
Flash Point(°F)194 °F
Flash Point(°C)90 °C
Boil Point(°C)205°C
Molecular Weight161.030 g/mol
XLogP34.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass159.985 Da
Monoisotopic Mass159.985 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count9
Formal Charge0
Complexity92.900
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Documents & Articles
Solution Calculators
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