Carbonato de bencilo y fenilo - ≥95%(GC) , CAS No.28170-07-2

CAS: 28170-07-2 Cat. No.: B153165 Peso molecular: 228.25 Beilstein Registry Number: 6437 Número EC: 608-171-9

GRADE & PURITY ≥95%(GC)

Synonyms

Benzyl phenyl carbonate | B3574 | MFCD07784341 | AKOS015840331 | SNGLYCMNDNOLOF-UHFFFAOYSA- | DTXSID20457991 | AS-10178 | SCHEMBL697595 | C93458 | Phenyl benzyl carbonate | J-016997 | BENZYLPHENYLCARBONATE | Carbonic acid, phenyl phenylmethyl ester | SY05

Storage

Conservar a 2-8°C,cargado con argón

Shipped In

Hielo húmedo

Descripción general

El fenil carbonato bencílico puede utilizarse para sintetizar poliaminas protegidas con carbamato.

El fenil carbonato bencílico puede sintetizarse haciendo reaccionar cloroformato de fenilo con alcohol bencílico en presencia de piridina.

Specifications

Sinónimos

Benzyl phenyl carbonate | B3574 | MFCD07784341 | AKOS015840331 | SNGLYCMNDNOLOF-UHFFFAOYSA- | DTXSID20457991 | AS-10178 | SCHEMBL697595 | C93458 | Phenyl benzyl carbonate | J-016997 | BENZYLPHENYLCARBONATE | Carbonic acid, phenyl phenylmethyl ester | SY05

Especificaciones y pureza

≥95%(GC)

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C, cargado con argón

Enviado en

Hielo húmedo

Pureza

≥95%(GC)

Nombres e identificadores

• Pubchem Sid: 504766133
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766133
• Sonrisas canónicas: C1=CC=C(C=C1)COC(=O)OC2=CC=CC=C2
• IUPAC Name: benzyl phenyl carbonate
• InChIKey: SNGLYCMNDNOLOF-UHFFFAOYSA-N
• INCHI: 1S/C14H12O3/c15-14(17-13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H2
• Isómeros SMILES: C1=CC=C(C=C1)COC(=O)OC2=CC=CC=C2
• WGK Alemania: 3
• Peso molecular: 228.25
• Beilstein: 6437
• Reaxy-Rn: 2114960
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2114960&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Benzyloxycarbonyls
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzyloxycarbonyls
• Alternative Parents: Phenoxy compounds Carbonic acid diesters Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzyloxycarbonyl - Phenoxy compound - Carbonic acid diester - Carbonic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive
• Índice de refracción: 1.55
• Punto de inflamación (°F): >230 °F
• Punto de inflamación (°C): >110 °C
• Punto de ebullición (°C): 131°C
• Peso molecular: 228.240 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 228.079 Da
• Monoisotopic Mass: 228.079 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 228.000
• 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