2,2'-Dihydroxydiphenylmethane - ≥99% , CAS No.2467-02-9

CAS: 2467-02-9 Cat. No.: D156001 Summenformel: C₁₃H₁₂O₂ Molekulargewicht: 200.24 Beilstein Registry Number: 6(4)6657 EG-Nummer: 219-578-2

GRADE & PURITY ≥99%

Synonyms

KUC112930N | BIDD:ER0432 | MFCD00002243 | 2-(2-hydroxybenzyl)phenol | bis-(2-hydroxyphenyl)methane | bis-(2-hydroxy-phenyl)-methane | Bis(2-hydroxyphenyl)methane | O,O'-BIS(HYDROXYPHENYL)METHANE | MQCPOLNSJCWPGT-UHFFFAOYSA- | Phenol, 2,2'-methylenebis- |

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

KUC112930N | BIDD:ER0432 | MFCD00002243 | 2-(2-hydroxybenzyl)phenol | bis-(2-hydroxyphenyl)methane | bis-(2-hydroxy-phenyl)-methane | Bis(2-hydroxyphenyl)methane | O,O'-BIS(HYDROXYPHENYL)METHANE | MQCPOLNSJCWPGT-UHFFFAOYSA- | Phenol, 2,2'-methylenebis- |

Spezifikationen & Reinheit

≥99%

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥99%

Namen und Kennungen

• Pubchem Sid: 488185133
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488185133
• Kanonisches Lächeln: C1=CC=C(C(=C1)CC2=CC=CC=C2O)O
• IUPAC Name: 2-[(2-hydroxyphenyl)methyl]phenol
• InChIKey: MQCPOLNSJCWPGT-UHFFFAOYSA-N
• INCHI: 1S/C13H12O2/c14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)15/h1-8,14-15H,9H2
• Isomere SMILES: C1=CC=C(C(=C1)CC2=CC=CC=C2O)O
• Molekulargewicht: 200.24
• Beilstein: 6(4)6657
• Reaxy-Rn: 1640599
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1640599&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: 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylmethane - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - 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: diarylmethane

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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Discover Target: HSPA5

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Escherichia coli (133304 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Air Sensitive
• Schmelzpunkt (°C): 118 °C
• Molekulargewicht: 200.230 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 200.084 Da
• Monoisotopic Mass: 200.084 Da
• Topological Polar Surface Area: 40.500 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