ethyl cis-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclopropanecarboxylate - ≥97% , CAS No.2135443-14-8

CAS: 2135443-14-8 Cat. No.: E631747 Molecular Weight: 240.1 EC Number: 888-893-0

GRADE & PURITY ≥97%

Synonyms

2135443-14-8 | Ethyl (1R,2S)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclopropane-1-carboxylate | AT30214 | EN300-7430523 | Z3326870470 | rac-ethyl (1R,2S)-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)cyclopropane-1-carboxylate | ETHYL CIS-2-(4,4,5,5-TET

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

2135443-14-8 | Ethyl (1R, 2S)-2-(4, 4, 5, 5-tetramethyl-1, 3, 2-dioxaborolan-2-yl)cyclopropane-1-carboxylate | AT30214 | EN300-7430523 | Z3326870470 | rac-ethyl (1R, 2S)-2-(tetramethyl-1, 3, 2-dioxaborolan-2-yl)cyclopropane-1-carboxylate | ETHYL CIS-2-(4, 4, 5, 5-TET

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: B1(OC(C(O1)(C)C)(C)C)C2CC2C(=O)OCC
• IUPAC Name: ethyl (1R,2S)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclopropane-1-carboxylate
• InChIKey: AAORUCVESAXSRS-BDAKNGLRSA-N
• INCHI: 1S/C12H21BO4/c1-6-15-10(14)8-7-9(8)13-16-11(2,3)12(4,5)17-13/h8-9H,6-7H2,1-5H3/t8-,9+/m1/s1
• Isomeric SMILES: B1(OC(C(O1)(C)C)(C)C)[C@H]2C[C@H]2C(=O)OCC
• Molecular Weight: 240.1
• Reaxy-Rn: 20118788
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=20118788&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Fatty Acyls
      • Subclass Fatty acid esters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Fatty Acyls
• Subclass: Fatty acid esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty acid esters
• Alternative Parents: Cyclopropanecarboxylic acids and derivatives Dioxaborolanes Boronic acid esters Carboxylic acid esters Oxacyclic compounds Organic metalloid salts Monocarboxylic acids and derivatives Organooxygen compounds Organoboron compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Fatty acid ester - Cyclopropanecarboxylic acid or derivatives - 1,3,2-dioxaborolane - Boronic acid ester - Carboxylic acid ester - Boronic acid derivative - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organoboron compound - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
• 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