Phenolphthalein - 10mM in DMSO , CAS No.77-09-8

CAS: 77-09-8 Cat. No.: P425897 Formula: C₂₀H₁₄O₄ Peso molecolare: 318.33 Beilstein Registry Number: 284423 Numero EC: 201-004-7

QUALITÀ & PUREZZA 10mM in DMSO

Synonyms

phenolphthalein|77-09-8|Phthalimetten|Euchessina|Phthalin|Espotabs|Phenolax|Purgophen|Koprol|Laxogen|Trilax|Purga|Spulmako-lax|Purgen|Medilax|Colax|Laxin|FemiLax|Dihydroxyphthalophenone|3,3-Bis(4-hydroxyphenyl)phthalide|3,3-Bis(4-hydroxyphenyl)-1(3H)-isob

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifiche

Sinonimi

phenolphthalein | 77-09-8 | Phthalimetten | Euchessina | Phthalin | Espotabs | Phenolax | Purgophen | Koprol | Laxogen | Trilax | Purga | Spulmako-lax | Purgen | Medilax | Colax | Laxin | FemiLax | Dihydroxyphthalophenone | 3,3-Bis(4-hydroxyphenyl)phthalide | 3,3-Bis(4-hydroxyphenyl)-1(3H)-isob

Specifiche e purezza

10mM in DMSO

Condizioni di conservazione di stoccaggio

Store at -80°C

Spedito in

Dry ice packs + Cold packs

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Proprietà del prodotto

ALogP

3.6

Nomi e identificatori

Pubchem Sid

528775943

Sorrisi canonici

C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O

IUPAC Name

3,3-bis(4-hydroxyphenyl)-2-benzofuran-1-one

InChIKey

KJFMBFZCATUALV-UHFFFAOYSA-N

INCHI

1S/C20H14O4/c21-15-9-5-13(6-10-15)20(14-7-11-16(22)12-8-14)18-4-2-1-3-17(18)19(23)24-20/h1-12,21-22H

Isomeri SMILES

C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O

WGK Germania

3

Numero UN

1993

Gruppo di imballaggio

I

Peso molecolare

318.33

Beilstein

284423

Reaxy-Rn

284423

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=284423&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Benzofurans
      • Subclass Benzofuranones

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Benzofurans
• Subclass: Benzofuranones
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzofuranones
• Alternative Parents: Phthalides 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Lactones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzofuranone - Phthalide - Isobenzofuranone - Isocoumaran - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Monocyclic benzene moiety - Lactone - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as benzofuranones. These are organic compounds containing a benzene ring fused to a furanone.
• External Descriptors: phenols

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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Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: Moisture sensitive.
• Punto di fusione (°C): 262 °C
• Peso molecolare: 318.300 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 318.089 Da
• Monoisotopic Mass: 318.089 Da
• Topological Polar Surface Area: 66.800 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 438.000
• 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