1,2-Bis[(2S,5S)-2,5-dimethyl-1-phospholanyl]ethane - ≥98% , CAS No.136779-26-5

CAS: 136779-26-5 Cat. No.: B477550 Peso molecular: 258.32 Número EC: 621-504-2

GRADE & PURITY ≥98%

Synonyms

23B6D1OYCY | MFCD01073771 | (-)-1,2-Bis(2S,5S)-2,5-dimethylphospholano)ethane | (S,S)-Me-bpe [MI] | CS-0106015 | Phospholane, 1,1'-(1,2-ethanediyl)bis[2,5-dimethyl-, (2S,2'S,5S,5'S)- | Q27253738 | (-)-1,2-Bis((2S,5S)-2,5-(dimethylphospholan-1-yl))ethane |

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Descripción general

Description

DuPhos and BPE Ligands: Highly Efficient Privileged Ligands

Specifications

Sinónimos

23B6D1OYCY | MFCD01073771 | (-)-1, 2-Bis(2S, 5S)-2, 5-dimethylphospholano)ethane | (S, S)-Me-bpe [MI] | CS-0106015 | Phospholane, 1, 1'-(1, 2-ethanediyl)bis[2, 5-dimethyl-, (2S, 2'S, 5S, 5'S)- | Q27253738 | (-)-1, 2-Bis((2S, 5S)-2, 5-(dimethylphospholan-1-yl))ethane |

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: CC1CCC(P1CCP2C(CCC2C)C)C
• IUPAC Name: (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]ethyl]-2,5-dimethylphospholane
• InChIKey: IRCDUOCGSIGEAI-XUXIUFHCSA-N
• INCHI: 1S/C14H28P2/c1-11-5-6-12(2)15(11)9-10-16-13(3)7-8-14(16)4/h11-14H,5-10H2,1-4H3/t11-,12-,13-,14-/m0/s1
• Isómeros SMILES: C[C@H]1CC[C@@H](P1CCP2[C@H](CC[C@@H]2C)C)C
• WGK Alemania: 3
• Número ONU: 2845
• Grupo de embalaje: I
• Peso molecular: 258.32
• Reaxy-Rn: 13659297
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13659297&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Metalloheterocyclic compounds
      • Subclass Phospholanes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Metalloheterocyclic compounds
• Subclass: Phospholanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Phospholanes
• Alternative Parents: Organic phosphines and derivatives Phosphacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Phospholane - Phosphine - Phosphacycle - Organopnictogen compound - Hydrocarbon derivative - Organophosphorus compound - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phospholanes. These are compounds containing a phospholane ring, which is a five-member saturated aliphatic heterocycle with one phosphorus atom and four carbon atoms.
• 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

Propiedades químicas y físicas

• Sensibilidad: air sensitive；light sensitive
• Índice de refracción: 1.5350
• Rotación específica [α]: 263° ±3°(c 1, hexane)
• Punto de ebullición (°C): 64-67°/0.06mm
• Peso molecular: 258.320 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 258.167 Da
• Monoisotopic Mass: 258.167 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 185.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• 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