3,3'-Diaminodiphenylmethane - ≥98%(T) , CAS No.19471-12-6

CAS: 19471-12-6 Cat. No.: D132695 Summenformel: C₁₃H₁₄N₂ Molekulargewicht: 198.27 Beilstein Registry Number: 13(2)110 EG-Nummer: 624-884-8

GRADE & PURITY ≥98%(T)

Synonyms

T70503 | 3,3'-Methylenedianiline | 3-[(3-aminophenyl)methyl]aniline | 3-(3-Aminobenzyl)phenylamine | AR-299/42656413 | Benzenamine, 3,3'-methylenebis- | 3,3'-methylene dianiline | 3,3'-Methylenedianiline, 97% | FT-0614040 | A813743 | 3,3'-Diaminodiphenylm

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyme

T70503 | 3,3'-Methylenedianiline | 3-[(3-aminophenyl)methyl]aniline | 3-(3-Aminobenzyl)phenylamine | AR-299/42656413 | Benzenamine, 3,3'-methylenebis- | 3,3'-methylene dianiline | 3,3'-Methylenedianiline, 97% | FT-0614040 | A813743 | 3,3'-Diaminodiphenylm

Spezifikationen & Reinheit

≥98%(T)

Storage

Argon charged,Room temperature

Verschickt in

Normal

Reinheit

≥98%(T)

Namen und Kennungen

Pubchem Sid

488188204

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488188204

Kanonisches Lächeln

C1=CC(=CC(=C1)N)CC2=CC(=CC=C2)N

IUPAC Name

3-[(3-aminophenyl)methyl]aniline

InChIKey

CKOFBUUFHALZGK-UHFFFAOYSA-N

INCHI

1S/C13H14N2/c14-12-5-1-3-10(8-12)7-11-4-2-6-13(15)9-11/h1-6,8-9H,7,14-15H2

Isomere SMILES

C1=CC(=CC(=C1)N)CC2=CC(=CC=C2)N

Molekulargewicht

198.27

Beilstein

13(2)110

Reaxy-Rn

2100449

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2100449&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Diphenylmethanes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Diphenylmethanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylmethanes
• Alternative Parents: Aniline and substituted anilines Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylmethane - Aniline or substituted anilines - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
• 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Air sensitive
• Schmelzpunkt (°C): 85 °C
• Molekulargewicht: 198.260 g/mol
• XLogP3: 2.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 198.116 Da
• Monoisotopic Mass: 198.116 Da
• Topological Polar Surface Area: 52.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 173.000
• 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: 1

Häufig gestellte Fragen

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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 19471-12-6, the molecular formula is C13H14N2, and the molecular weight is 198.27 g/mol. InChIKey CKOFBUUFHALZGK-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.