(+)-alfa-pinene - ≥99% , CAS No.7785-70-8

CAS: 7785-70-8 Cat. No.: P124468 Formula: C₁₀H₁₆ Peso molecolare: 136.24 Beilstein Registry Number: 2038653 Numero EC: 232-087-8

GRADE & PURITY ≥99%

Synonyms

(1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene | 2-PINENE, (1R,5R)-(+)- | H6CM4TWH1W | EC 232-087-8 | (R)-(+)-.ALPHA.-PINENE | HY-Y0739 | 4-Phenylthio-2-aminonitrobenzene | (R)-(+)--Pinene;(+)--Pinene; (1R)-(+)--Pinene; (1R)--Pinene; (1R,5R)-(+)--Pinene

Storage

Conservare a 2-8°C

Shipped In

Ghiaccio umido

Panoramica

il (+)-α-pinene può essere utilizzato come precursore per preparare alcoli γ-ammino primari, secondari e terziari e 1,3-diammine, che possono essere utilizzati come catalizzatori chirali per l'addizione di dietilzinco ad aldeidi aromatiche, ottenendo 1-aril-1-propanoli chirali con elevata enantioselettività.

Impiegati nella preparazione di reagenti di idroborazione chirale

il (+)-α-Pinene è un composto monoterpenoide presente principalmente nelle specie di Pinus.

Specifications

Sinonimi

(1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene | 2-PINENE, (1R,5R)-(+)- | H6CM4TWH1W | EC 232-087-8 | (R)-(+)-.ALPHA.-PINENE | HY-Y0739 | 4-Phenylthio-2-aminonitrobenzene | (R)-(+)--Pinene;(+)--Pinene; (1R)-(+)--Pinene; (1R)--Pinene; (1R,5R)-(+)--Pinene

Specifiche e purezza

≥99%

Condizioni di conservazione di stoccaggio

Conservare a 2-8°C

Spedito in

Ghiaccio umido

Tipo di azione

INHIBITOR

Purezza

≥99%

Nomi e identificatori

Pubchem Sid

508806374

Sorrisi canonici

CC1=CCC2CC1C2(C)C

IUPAC Name

(1R,5R)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene

InChIKey

GRWFGVWFFZKLTI-RKDXNWHRSA-N

INCHI

1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,9-/m1/s1

Isomeri SMILES

CC1=CC[C@@H]2C[C@H]1C2(C)C

WGK Germania

3

Numero UN

2368

Peso molecolare

136.24

Beilstein

2038653

Reaxy-Rn

1560714

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1560714&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Prenol lipids
      • Subclass Monoterpenoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Prenol lipids
• Subclass: Monoterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Bicyclic monoterpenoids
• Alternative Parents: Polycyclic hydrocarbons Branched unsaturated hydrocarbons Cyclic olefins Unsaturated aliphatic hydrocarbons
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Pinane monoterpenoid - Bicyclic monoterpenoid - Branched unsaturated hydrocarbon - Polycyclic hydrocarbon - Cyclic olefin - Unsaturated aliphatic hydrocarbon - Unsaturated hydrocarbon - Olefin - Hydrocarbon - Aliphatic homopolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
• External Descriptors: Bicyclic monoterpenoids

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

Obiettivi associati (umani)

U373 MG (658 Activities)

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MAPK13 Tchem MAP kinase p38 (1586 Activities)

Discover Target: MAPK13

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in Ether, Alcohols, Chloroform. Not miscible in water.
• Indice di rifrazione: 1.47
• Rotazione specifica [α]: +42.0 to +46.0 deg-C(neat)
• Punto di infiammabilità (°F): 89°F
• Punto di infiammabilità (°C): 32°C
• Punto di ebollizione (°C): 154-156°C
• Punto di fusione (°C): -62°C
• Peso molecolare: 136.230 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 136.125 Da
• Monoisotopic Mass: 136.125 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 186.000
• 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