3,5-Dichloroaniline - ≥98%(GC) , CAS No.626-43-7

CAS: 626-43-7 Cat. No.: D154511 Molecular Weight: 162.01 Beilstein Registry Number: 636492 EC Number: 210-948-9

GRADE & PURITY ≥98%(GC)

Synonyms

SCHEMBL127074 | D0325 | SMR001370887 | Aniline, 3,5-dichloro- | HMS3039J09 | NCGC00091306-02 | UNII-OZ75ZM1S3G | iprodione TP4 | 3,5-dichloro benzenamine | Benzenamine, 3,5-dichloro- | F2190-0506 | STR00530 | 3,5-dichlorophenylamine | EINECS 210-948-9 | A

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifications

Synonyms

SCHEMBL127074 | D0325 | SMR001370887 | Aniline, 3, 5-dichloro- | HMS3039J09 | NCGC00091306-02 | UNII-OZ75ZM1S3G | iprodione TP4 | 3, 5-dichloro benzenamine | Benzenamine, 3, 5-dichloro- | F2190-0506 | STR00530 | 3, 5-dichlorophenylamine | EINECS 210-948-9 | A

Specifications & Purity

≥98%(GC)

Storage

Room temperature, Argon charged

Shipped In

FedEx DG Service

Purity

≥98%(GC)

Names and Identifiers

• Pubchem Sid: 504752297
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752297
• Canonical Smiles: C1=C(C=C(C=C1Cl)Cl)N
• IUPAC Name: 3,5-dichloroaniline
• InChIKey: UQRLKWGPEVNVHT-UHFFFAOYSA-N
• INCHI: 1S/C6H5Cl2N/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2
• Isomeric SMILES: C1=C(C=C(C=C1Cl)Cl)N
• WGK Germany: 3
• Molecular Weight: 162.01
• Beilstein: 636492
• Reaxy-Rn: 636492
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=636492&ln=

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: Aniline and substituted anilines Aryl chlorides Primary amines Organopnictogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - 1,3-dichlorobenzene - Aryl halide - Aryl chloride - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - 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: dichloroaniline

Data sources

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

Associated Targets(Human)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CXCL8 Tchem Interleukin-8 (642 Activities)

Discover Target: CXCL8

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

Discover Target: CYP3A4

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TP53 Tchem Cellular tumor antigen p53 (48468 Activities)

Discover Target: TP53

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Plasmodium falciparum (966862 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)

Discover Target: Nfe2l2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Light & Air Sensitive
• Flash Point(°F): 271 °F
• Flash Point(°C): 133 °C
• Boil Point(°C): 259-260 °C/741 mmHg
• Melt Point(°C): 46-52°C
• Molecular Weight: 162.010 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 160.98 Da
• Monoisotopic Mass: 160.98 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 87.100
• 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

References

1. Yibo Dong, Xiaolong Yao, Wanping Zhang, Xiaomao Wu.  (2023)  Development of Simultaneous Determination Method of Pesticide High Toxic Metabolite 3,4-Dichloroaniline and 3,5 Dichloroaniline in Chives Using HPLC-MS/MS.  Foods,  12  (15): (2875).  [PMID:37569143] [10.3390/foods12152875]

2. Jingjing Yao, Xinxin Xu, Haiying Liu, Liguang Xu, Liqiang Liu, Hua Kuang, Chuanlai Xu.  (2022)  Sensitive immunochromatographic assay for the detection of the dimethachlone fungicide in tomatoes and lettuces.  NEW JOURNAL OF CHEMISTRY,  46  (18): (8592-8600).  [PMID:] [10.1039/D2NJ00721E]

3. Kaihua Pan, Weihao Zhu, Yanni Huang, Changchang Wang, Hongfei Liu, Qian Li, Qian Zhu, Junqiang Hu, Mingliang Zhang, Jiguo Qiu, Xin Yan, Qing Hong.  (2025)  Unveiling the degradation mechanism of 3,5-dichloroaniline: Activated sludge acclimation, strain isolation and gene cloning.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:39869974] [10.1016/j.jhazmat.2025.137337]

4. Jing Yang, Guy Smagghe, Xiaomao Wu, Wanping Zhang, Xiangsheng Chen.  (2026)  Divergent impacts of conventional and biodegradable microplastics on pesticide fate and toxicity in a soil–chive system, underscoring a soil-plant-microbe disruption.  PESTICIDE BIOCHEMISTRY AND PHYSIOLOGY,      [PMID:41629037] [10.1016/j.pestbp.2026.106971]