(4-(4-Chlorophenoxy)phenyl)methanamine hydrochloride - ≥95% , CAS No.262862-71-5

CAS: 262862-71-5 Cat. No.: C192406 Formule: C₁₃H₁₃Cl₂NO Poids moléculaire: 270.15 PubChem CID: 17749861

GRADE & PURITY ≥95%

Synonyms

MFCD02089410 | AS-45226 | SCHEMBL6159403 | (4-(4-Chlorophenoxy)phenyl)methanamine, HCl | [4-(4-Chlorophenoxy)phenyl]methylamine hydrochloride | SB36276 | DTXSID20590034 | (4-(4-Chlorophenoxy)phenyl)methanaminehydrochloride | AKOS015846504 | [4-(4-chloroph

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

MFCD02089410 | AS-45226 | SCHEMBL6159403 | (4-(4-Chlorophenoxy)phenyl)methanamine, HCl | [4-(4-Chlorophenoxy)phenyl]methylamine hydrochloride | SB36276 | DTXSID20590034 | (4-(4-Chlorophenoxy)phenyl)methanaminehydrochloride | AKOS015846504 | [4-(4-chloroph

Spécifications et pureté

≥95%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥95%

Noms et identifiants

Sourires canoniques

C1=CC(=CC=C1CN)OC2=CC=C(C=C2)Cl.Cl

IUPAC Name

[4-(4-chlorophenoxy)phenyl]methanamine;hydrochloride

InChIKey

BFQVELFTOFIOEB-UHFFFAOYSA-N

INCHI

1S/C13H12ClNO.ClH/c14-11-3-7-13(8-4-11)16-12-5-1-10(9-15)2-6-12;/h1-8H,9,15H2;1H

Isomères SMILES

C1=CC(=CC=C1CN)OC2=CC=C(C=C2)Cl.Cl

PubChem CID

17749861

Poids moléculaire

270.15

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Diphenylethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylethers
• Alternative Parents: Diarylethers Phenylmethylamines Phenoxy compounds Phenol ethers Benzylamines Chlorobenzenes Aralkylamines Aryl chlorides Organochlorides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylether - Diaryl ether - Phenoxy compound - Benzylamine - Phenylmethylamine - Phenol ether - Chlorobenzene - Aralkylamine - Halobenzene - Aryl chloride - Aryl halide - Ether - Amine - Organochloride - Organohalogen compound - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrochloride - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether 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

Propriétés chimiques et physiques

• Poids moléculaire: 270.150 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 269.037 Da
• Monoisotopic Mass: 269.037 Da
• Topological Polar Surface Area: 35.300 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 196.000
• 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: 2

XLogP3

Foire aux questions

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). 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 ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 262862-71-5, the molecular formula is C13H13Cl2NO, and the molecular weight is 270.15 g/mol. InChIKey BFQVELFTOFIOEB-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.