(2R,5R)-2,5-Hexanediol - ≥98%(GC) , CAS No.17299-07-9

CAS: 17299-07-9 Cat. No.: R160953 Formula: C₆H₁₄O₂ Peso molecolare: 118.18 Beilstein Registry Number: 1719250 Numero EC: 624-343-6

GRADE & PURITY ≥98%(GC)

Synonyms

(2R,5R)-2,5-Hexanediol | Q27461257 | 2,5-Hexanediol,(2R,5R)- | T71918 | AKOS015839970 | (2R,5R)-2,5-Hexanediol, >=99.0% (sum of enantiomers, GC) | (2r,5r)-hexanediol | RAC-2,5-dihydroxyhexane | (-)-2,5-Hexanediol | 2,5-Hexanediol, (R*,R*)- | (r,r)-2,5-hex

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinonimi

(2R,5R)-2,5-Hexanediol | Q27461257 | 2,5-Hexanediol,(2R,5R)- | T71918 | AKOS015839970 | (2R,5R)-2,5-Hexanediol, >=99.0% (sum of enantiomers, GC) | (2r,5r)-hexanediol | RAC-2,5-dihydroxyhexane | (-)-2,5-Hexanediol | 2,5-Hexanediol, (R*,R*)- | (r,r)-2,5-hex

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

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

Purezza

≥98%(GC)

Nomi e identificatori

• Pubchem Sid: 504760997
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504760997
• Sorrisi canonici: CC(CCC(C)O)O
• IUPAC Name: (2R,5R)-hexane-2,5-diol
• InChIKey: OHMBHFSEKCCCBW-PHDIDXHHSA-N
• INCHI: 1S/C6H14O2/c1-5(7)3-4-6(2)8/h5-8H,3-4H2,1-2H3/t5-,6-/m1/s1
• Isomeri SMILES: C[C@H](CC[C@@H](C)O)O
• WGK Germania: 3
• Peso molecolare: 118.18
• Beilstein: 1719250
• Reaxy-Rn: 1719248
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1719248&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: Secondary alcohols
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary alcohol - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl).
• 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

Proprietà chimiche e fisiche

• Sensibilità: Moisture sensitive.
• Rotazione specifica [α]: -25° (C=1,EtOH)
• Punto di fusione (°C): 52 - 54°C
• Peso molecolare: 118.170 g/mol
• XLogP3: 0.400
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 118.099 Da
• Monoisotopic Mass: 118.099 Da
• Topological Polar Surface Area: 40.500 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 46.500
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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

Domande frequenti

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

This product is supplied at ≥98% 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 17299-07-9, the molecular formula is C6H14O2, and the molecular weight is 118.18 g/mol. InChIKey OHMBHFSEKCCCBW-PHDIDXHHSA-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.