2,4-Dimethyl-2,4-pentanediol - ≥96%(GC) , CAS No.24892-49-7

CAS: 24892-49-7 Cat. No.: D154710 Formule: C₇H₁₆O₂ Poids moléculaire: 132.2 Beilstein Registry Number: 1(3)2217

GRADE & PURITY ≥96%(GC)

Synonyms

DTXSID50179598 | 2,4-Dimethyl-2,4-pentanediol, 99% | 2,4-Dimethyl-2,4-pentanediol | 2,4-Dimethylpentane-2,4-diol | T70643 | D1946 | Q27462060 | KP1 | SCHEMBL38006 | DBTGFWMBFZBBEF-UHFFFAOYSA- | SY051863 | AS-60388 | MFCD00012306 | J-015719 | InChI=1/C7H16

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Vue d’ensemble

application：

Its Cr(VI) ester catalyzes the peroxyacetic acid oxidation of secondary alcohols to ketones. The chromate ester is easily prepared in situ.

Specifications

Synonymes

DTXSID50179598 | 2,4-Dimethyl-2,4-pentanediol, 99% | 2,4-Dimethyl-2,4-pentanediol | 2,4-Dimethylpentane-2,4-diol | T70643 | D1946 | Q27462060 | KP1 | SCHEMBL38006 | DBTGFWMBFZBBEF-UHFFFAOYSA- | SY051863 | AS-60388 | MFCD00012306 | J-015719 | InChI=1/C7H16

Spécifications et pureté

≥96%(GC)

Conditions de stockage de stockage

Store at 2-8°C,Argon charged

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥96%(GC)

Noms et identifiants

Pubchem Sid

504757225

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504757225

Sourires canoniques

CC(C)(CC(C)(C)O)O

IUPAC Name

2,4-dimethylpentane-2,4-diol

InChIKey

DBTGFWMBFZBBEF-UHFFFAOYSA-N

INCHI

1S/C7H16O2/c1-6(2,8)5-7(3,4)9/h8-9H,5H2,1-4H3

Isomères SMILES

CC(C)(CC(C)(C)O)O

Poids moléculaire

132.2

Beilstein

1(3)2217

Reaxy-Rn

1304453

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1304453&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Alcohols and polyols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Tertiary alcohols
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tertiary alcohol - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as tertiary alcohols. These are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ).
• 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

Propriétés chimiques et physiques

• Sensibilité: Hygroscopic ；heat sensitive；air sensitive
• Indice de réfraction: n20/D 1.433 (lit.)
• Point d'éclair (°C): 85°C(lit.)
• Point d'ébullition (°C): 100°C/17mmHg(lit.)
• Point de fusion (°C): 8 °C
• Poids moléculaire: 132.200 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 132.115 Da
• Monoisotopic Mass: 132.115 Da
• Topological Polar Surface Area: 40.500 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 83.100
• 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

Foire aux questions

What is the purity of this product, and how is it determined?

This product is supplied at ≥96% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 24892-49-7, the molecular formula is C7H16O2, and the molecular weight is 132.2 g/mol. InChIKey DBTGFWMBFZBBEF-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.