Diallyl carbonate - ≥97% , CAS No.15022-08-9

CAS: 15022-08-9 Cat. No.: D474233 Formula: (H₂C=CHCH₂O)₂CO Peso molecolare: 142.15 Numero EC: 239-106-9

QUALITÀ & PUREZZA ≥97%

Synonyms

DTXSID6065846 | EINECS 239-106-9 | Carbonic acid, diallyl ester | F87809 | NSC 19177 | SCHEMBL9928 | Diallyl carbonate, 99% | NSC19177 | NSC-19177 | Carbonic acid, di-2-propen-1-yl ester | BS-27398 | Diallyl carbonate | di-allyl carbonate | MFCD00008645 |

Storage

Store at 2-8°C

Shipped In

Wet ice

Panoramica

Diallyl carbonate is an acrylating agent. Allyl carbonates are widely employed in Tsuji-Trost allylation, generating carbanion, boronate, phosphide, amide and alkoxide, nucleophiles in situ and improving reaction rates over allyl acetate. Allyl carbonates are also of considerable interest for the intramolecular decarboxylative assymetric couplings.Transesterification of diallyl carbonate with glycerol in the presence of a catalyst (Pd/PPh3), generates glycerol carbonate.

Specifiche

Sinonimi

DTXSID6065846 | EINECS 239-106-9 | Carbonic acid, diallyl ester | F87809 | NSC 19177 | SCHEMBL9928 | Diallyl carbonate, 99% | NSC19177 | NSC-19177 | Carbonic acid, di-2-propen-1-yl ester | BS-27398 | Diallyl carbonate | di-allyl carbonate | MFCD00008645 |

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Store at 2-8°C

Spedito in

Wet ice

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

Purezza

≥97%

Nomi e identificatori

Pubchem Sid

504755772

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755772

Sorrisi canonici

C=CCOC(=O)OCC=C

IUPAC Name

bis(prop-2-enyl) carbonate

InChIKey

JKJWYKGYGWOAHT-UHFFFAOYSA-N

INCHI

1S/C7H10O3/c1-3-5-9-7(8)10-6-4-2/h3-4H,1-2,5-6H2

Isomeri SMILES

C=CCOC(=O)OCC=C

Numero UN

3272

Peso molecolare

142.15

Reaxy-Rn

1754238

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1754238&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Organic carbonic acids and derivatives
      • Subclass Carbonic acid diesters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Organic carbonic acids and derivatives
• Subclass: Carbonic acid diesters
• Intermediate Tree Nodes: Not available
• Direct Parent: Carbonic acid diesters
• Alternative Parents: Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carbonic acid diester - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as carbonic acid diesters. These are compounds comprising the carbonic acid diester functional group.
• 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

• Indice di rifrazione: n20/D 1.428 (lit.)
• Punto di infiammabilità (°F): 138.2 °F - closed cup
• Punto di infiammabilità (°C): 59 °C - closed cup
• Punto di ebollizione (°C): 95-97℃/60mmHg (lit.)
• Peso molecolare: 142.150 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 142.063 Da
• Monoisotopic Mass: 142.063 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 115.000
• 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