2,2-Diphenylethanol - ≥99% , CAS No.1883-32-5

CAS: 1883-32-5 Cat. No.: D770538 Summenformel: C₁₄H₁₄O Molekulargewicht: 198.26 EG-Nummer: 217-543-6

QUALITÄT & REINHEIT ≥99%

Synonyms

2,2-Diphenylethan-1-ol|β-Phenylbenzeneethanol

Storage

Room temperature

Shipped In

Normal

Spezifikationen

Synonyme

2,2-Diphenylethan-1-ol | β-Phenylbenzeneethanol

Spezifikationen & Reinheit

≥99%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥99%

Namen und Kennungen

Kanonisches Lächeln

C1=CC=C(C=C1)C(CO)C2=CC=CC=C2

IUPAC Name

2,2-diphenylethanol

InChIKey

NYLOEXLAXYHOHH-UHFFFAOYSA-N

INCHI

1S/C14H14O/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14-15H,11H2

Isomere SMILES

C1=CC=C(C=C1)C(CO)C2=CC=CC=C2

WGK Deutschland

3

Molekulargewicht

198.26

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: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylmethane - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - 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

Chemische und physikalische Eigenschaften

• Flammpunkt (°F): >235.4 °F
• Flammpunkt (°C): 113℃
• Siedepunkt (°C): 190-192°C
• Schmelzpunkt (°C): 53-61°C
• Molekulargewicht: 198.260 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 198.104 Da
• Monoisotopic Mass: 198.104 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 148.000
• 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