Dibenzyl Dicarbonate - ≥97% , CAS No.31139-36-3

CAS: 31139-36-3 Cat. No.: D154141 分子式: C₁₆H₁₄O₅ 分子量: 286.28 Beilstein Registry Number: 4324800 EC番号: 629-545-8

GRADE & PURITY ≥97%

Synonyms

Z2O | MFCD00043124 | Dibenzyl dicarbonate | FS-4658 | SCHEMBL48133 | FHRRJZZGSJXPRQ-UHFFFAOYSA-N | Benzyl Phenylmethoxycarbonyl Carbonate | Dibenzyl dicarbonate, 97% | Dicarbonic acid, bis(phenylmethyl) ester | P1281 | FT-0638952 | J-018255 | (PhCH2OCO)2O

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

同義語

Z2O | MFCD00043124 | Dibenzyl dicarbonate | FS-4658 | SCHEMBL48133 | FHRRJZZGSJXPRQ-UHFFFAOYSA-N | Benzyl Phenylmethoxycarbonyl Carbonate | Dibenzyl dicarbonate, 97% | Dicarbonic acid, bis(phenylmethyl) ester | P1281 | FT-0638952 | J-018255 | (PhCH2OCO)2O

仕様と純度

≥97%

保管条件

Store at -20°C,Argon charged

入荷

Ice chest + Ice pads

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥97%

名前と識別子

• パブケム・シド: 528769740
• カノニカル・スマイル: C1=CC=C(C=C1)COC(=O)OC(=O)OCC2=CC=CC=C2
• IUPAC Name: benzyl phenylmethoxycarbonyl carbonate
• InChIKey: FHRRJZZGSJXPRQ-UHFFFAOYSA-N
• INCHI: 1S/C16H14O5/c17-15(19-11-13-7-3-1-4-8-13)21-16(18)20-12-14-9-5-2-6-10-14/h1-10H,11-12H2
• 異性体SMILES: C1=CC=C(C=C1)COC(=O)OC(=O)OCC2=CC=CC=C2
• WGKドイツ: 3
• 分子量: 286.28
• Beilstein: 4324800
• Reaxy-Rn: 4324796
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4324796&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 分類 Benzene and substituted derivatives
      • Subclass Benzyloxycarbonyls

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 分類: Benzene and substituted derivatives
• Subclass: Benzyloxycarbonyls
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzyloxycarbonyls
• Alternative Parents: Organic carbonic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzyloxycarbonyl - Carbonic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as benzyloxycarbonyls. These are organic compounds containing a carbonyl group substituted with a benzyloxyl 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

化学的性質と物理的性質

• 感度: Moisture Sensitive,Heat Sensitive
• 融点（°C）: 23 °C
• 分子量: 286.280 g/mol
• XLogP3: 3.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 286.084 Da
• Monoisotopic Mass: 286.084 Da
• Topological Polar Surface Area: 61.800 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 298.000
• 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