2-(Hydroxymethyl)anthracene - ≥98% , CAS No.22863-82-7

CAS: 22863-82-7 Cat. No.: H156854 Summenformel: C₁₅H₁₂O Molekulargewicht: 208.26

GRADE & PURITY ≥98%

Synonyms

H0750 | FT-0608818 | DTXSID90360908 | XAA86382 | AKOS015856351 | 2-hydroxymethylanthracene | 2-Anthracenemethanol | T72115 | 2-(Hydroxymethyl)anthracene; | SCHEMBL3923568 | Anthracen-2-ylmethanol | ZMUUBYLNJMTHBS-UHFFFAOYSA-N | (2-Anthracenyl)methanol | A

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyme

H0750 | FT-0608818 | DTXSID90360908 | XAA86382 | AKOS015856351 | 2-hydroxymethylanthracene | 2-Anthracenemethanol | T72115 | 2-(Hydroxymethyl)anthracene; | SCHEMBL3923568 | Anthracen-2-ylmethanol | ZMUUBYLNJMTHBS-UHFFFAOYSA-N | (2-Anthracenyl)methanol | A

Spezifikationen & Reinheit

≥98%

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 504760410
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504760410
• Kanonisches Lächeln: C1=CC=C2C=C3C=C(C=CC3=CC2=C1)CO
• IUPAC Name: anthracen-2-ylmethanol
• InChIKey: ZMUUBYLNJMTHBS-UHFFFAOYSA-N
• INCHI: 1S/C15H12O/c16-10-11-5-6-14-8-12-3-1-2-4-13(12)9-15(14)7-11/h1-9,16H,10H2
• Isomere SMILES: C1=CC=C2C=C3C=C(C=CC3=CC2=C1)CO
• Molekulargewicht: 208.26
• Reaxy-Rn: 2367906
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2367906&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Anthracenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Anthracenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Anthracenes
• Alternative Parents: Primary alcohols Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Anthracene - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Primary alcohol - Organooxygen compound - Alcohol - Aromatic homopolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as anthracenes. These are organic compounds containing a system of three linearly fused benzene rings.
• 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

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MCF7 (126967 Activities)

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HCT-116 (91556 Activities)

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NCI-H460 (60772 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Schmelzpunkt (°C): 224 °C
• Molekulargewicht: 208.250 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 208.089 Da
• Monoisotopic Mass: 208.089 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 238.000
• 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