Leucocrystal Violet - ≥98% , CAS No.603-48-5

CAS: 603-48-5 Cat. No.: L109872 Molecular Weight: 373.53 Beilstein Registry Number: 13315 EC Number: 210-043-9

GRADE & PURITY ≥98%

Synonyms

LCV | 3vw1 | 4,4''-Methylidynetris(N,N-dimethylaniline) | 4-[bis[4-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline | AS-66577 | CI BASIC VIOLET 3, LEUCO | PD065506 | A-DMA | AI3-19978 | LCV | Tris(4-(dimethylamino)phenyl)methane | AKOS015903459 | STL416

Storage

Protected from light,Room temperature

Shipped In

Normal

Specifications

Synonyms

LCV | 3vw1 | 4, 4''-Methylidynetris(N, N-dimethylaniline) | 4-[bis[4-(dimethylamino)phenyl]methyl]-N, N-dimethylaniline | AS-66577 | CI BASIC VIOLET 3, LEUCO | PD065506 | A-DMA | AI3-19978 | LCV | Tris(4-(dimethylamino)phenyl)methane | AKOS015903459 | STL416

Specifications & Purity

≥98%

Storage

Protected from light, Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488184204
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184204
• Canonical Smiles: CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C
• IUPAC Name: 4-[bis[4-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline
• InChIKey: OAZWDJGLIYNYMU-UHFFFAOYSA-N
• INCHI: 1S/C25H31N3/c1-26(2)22-13-7-19(8-14-22)25(20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6/h7-18,25H,1-6H3
• Isomeric SMILES: CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C
• WGK Germany: 3
• Molecular Weight: 373.53
• Beilstein: 13315
• Reaxy-Rn: 2222570
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2222570&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Triphenyl compounds

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Triphenyl compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Triphenyl compounds
• Alternative Parents: Dialkylarylamines Aniline and substituted anilines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Triphenyl compound - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Monocyclic benzene moiety - Tertiary amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as triphenyl compounds. These are aromatic compounds containing a triphenyl moiety.
• 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

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Light sensitive/Air Sensitive
• Melt Point(°C): 175-177°C
• Molecular Weight: 373.500 g/mol
• XLogP3: 5.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 373.252 Da
• Monoisotopic Mass: 373.252 Da
• Topological Polar Surface Area: 9.700 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 370.000
• 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

References

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