5-Norbornene-2,2-dimethanol - ≥98% , CAS No.6707-12-6

CAS: 6707-12-6 Cat. No.: N473549 Formula: C₉H₁₄O₂ Peso molecolare: 154.21 Beilstein Registry Number: 6(3)4171 Numero EC: 624-593-6

QUALITÀ & PUREZZA ≥98%

Synonyms

FT-0694858 | 2,2-di-hydroxymethyl-norborn-5-ene | 2,2-bishydroxymethyl-5-norbornene | 5-Norbornene-2,2-dimethanol | Bicyclo[2.2.1]hept-5-ene-2,2-diyldimethanol | Bicyclo[2.2.1]hept-5-ene-2,2-dimethanol | DTXSID30884330 | [2-(hydroxymethyl)-2-bicyclo[2.2.1

Storage

Room temperature

Specifiche

Sinonimi

FT-0694858 | 2,2-di-hydroxymethyl-norborn-5-ene | 2,2-bishydroxymethyl-5-norbornene | 5-Norbornene-2,2-dimethanol | Bicyclo[2.2.1]hept-5-ene-2,2-diyldimethanol | Bicyclo[2.2.1]hept-5-ene-2,2-dimethanol | DTXSID30884330 | [2-(hydroxymethyl)-2-bicyclo[2.2.1

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Room temperature

Purezza

≥98%

Nomi e identificatori

Sorrisi canonici

C1C2CC(C1C=C2)(CO)CO

IUPAC Name

[2-(hydroxymethyl)-2-bicyclo[2.2.1]hept-5-enyl]methanol

InChIKey

DSHXMENPUICESR-UHFFFAOYSA-N

INCHI

1S/C9H14O2/c10-5-9(6-11)4-7-1-2-8(9)3-7/h1-2,7-8,10-11H,3-6H2

Isomeri SMILES

C1C2CC(C1C=C2)(CO)CO

Peso molecolare

154.21

Beilstein

6(3)4171

Reaxy-Rn

1862970

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1862970&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: Primary alcohols
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Hydrocarbon derivative - Primary alcohol - Aliphatic homopolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as primary alcohols. These are compounds comprising the primary alcohol functional group, with the general structure RCOH (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

• Punto di fusione (°C): 112 °C
• Peso molecolare: 154.210 g/mol
• XLogP3: 0.400
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 154.099 Da
• Monoisotopic Mass: 154.099 Da
• Topological Polar Surface Area: 40.500 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 182.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• 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?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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

The CAS Number is 6707-12-6, the molecular formula is C9H14O2, and the molecular weight is 154.21 g/mol. InChIKey DSHXMENPUICESR-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.