4-Chloro-2-methylaniline Hydrochloride - ≥98%(HPLC)(N) , CAS No.3165-93-3

CAS: 3165-93-3 Cat. No.: C153905 Formula: C₇H₈ClN·HCl Peso molecolare: 178.06 Numero EC: 221-627-8

GRADE & PURITY ≥98%(HPLC)(N)

Synonyms

4-Chloro-2-methylaniline hydrochloride|3165-93-3|4-CHLORO-O-TOLUIDINE HYDROCHLORIDE|Kromon Green B|Devol Red TR|Neutrosel Red TRVA|Devol Red K|Diazo Fast Red TR|Azogene Fast Red TR|2-Amino-5-chlorotoluene hydrochloride|2-Methyl-4-chloroaniline hydrochlori

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

Sinonimi

4-Chloro-2-methylaniline hydrochloride | 3165-93-3 | 4-CHLORO-O-TOLUIDINE HYDROCHLORIDE | Kromon Green B | Devol Red TR | Neutrosel Red TRVA | Devol Red K | Diazo Fast Red TR | Azogene Fast Red TR | 2-Amino-5-chlorotoluene hydrochloride | 2-Methyl-4-chloroaniline hydrochlori

Specifiche e purezza

≥98%(HPLC)(N)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

FedEx DG Service

Purezza

≥98%(HPLC)(N)

Nomi e identificatori

• Pubchem Sid: 488182479
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488182479
• Sorrisi canonici: CC1=C(C=CC(=C1)Cl)N.Cl
• IUPAC Name: 4-chloro-2-methylaniline;hydrochloride
• InChIKey: VKYZDCTWJGBFDW-UHFFFAOYSA-N
• INCHI: 1S/C7H8ClN.ClH/c1-5-4-6(8)2-3-7(5)9;/h2-4H,9H2,1H3;1H
• Isomeri SMILES: CC1=C(C=CC(=C1)Cl)N.Cl
• RTECS: XU5250000
• Numero UN: 1579
• Gruppo di imballaggio: III
• Peso molecolare: 178.06
• Reaxy-Rn: 5986883
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5986883&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Toluenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Toluenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminotoluenes
• Alternative Parents: Aniline and substituted anilines Chlorobenzenes Aryl chlorides Primary amines Organopnictogen compounds Organochlorides Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Aminotoluene - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Organic nitrogen compound - Hydrochloride - Primary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Organopnictogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as aminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and one amino group.
• External Descriptors: Not available

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

Proprietà chimiche e fisiche

• Peso molecolare: 178.060 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 177.011 Da
• Monoisotopic Mass: 177.011 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 94.900
• 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: 2

XLogP3

Domande frequenti

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by HPLC. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 3165-93-3, the molecular formula is C7H8ClN·HCl, and the molecular weight is 178.06 g/mol. InChIKey VKYZDCTWJGBFDW-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.