Cbz-NH-PEG2-CH2COOH - ≥95% , CAS No.165454-06-8

CAS: 165454-06-8 Cat. No.: O587567 Formula: C₁₄H₁₉NO₆ Peso molecolare: 297.3

GRADE & PURITY ≥95%

Synonyms

DS-5801 | 8-(benzyloxycarbonyl-amino)-3,6-dioxaoctanoic acid | 2-[2-[2-(phenylmethoxycarbonylamino)ethoxy]ethoxy]acetic acid | CBZ-8-AMINO-3,6-DIOXAOCTANOIC ACID DCHA | AM808138 | A882395 | CBZ-NH-PEG2-acetic acid | SCHEMBL127760 | AKOS016013205 | SY10926

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinonimi

DS-5801 | 8-(benzyloxycarbonyl-amino)-3,6-dioxaoctanoic acid | 2-[2-[2-(phenylmethoxycarbonylamino)ethoxy]ethoxy]acetic acid | CBZ-8-AMINO-3,6-DIOXAOCTANOIC ACID DCHA | AM808138 | A882395 | CBZ-NH-PEG2-acetic acid | SCHEMBL127760 | AKOS016013205 | SY10926

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

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Purezza

≥95%

Nomi e identificatori

Pubchem Sid

508810387

Sorrisi canonici

C1=CC=C(C=C1)COC(=O)NCCOCCOCC(=O)O

IUPAC Name

2-[2-[2-(phenylmethoxycarbonylamino)ethoxy]ethoxy]acetic acid

InChIKey

GWUWSVXMAZFFNT-UHFFFAOYSA-N

INCHI

1S/C14H19NO6/c16-13(17)11-20-9-8-19-7-6-15-14(18)21-10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H,15,18)(H,16,17)

Isomeri SMILES

C1=CC=C(C=C1)COC(=O)NCCOCCOCC(=O)O

Peso molecolare

297.3

Reaxy-Rn

9208703

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9208703&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzyloxycarbonyls
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzyloxycarbonyls
• Alternative Parents: Carbamate esters Monocarboxylic acids and derivatives Dialkyl ethers Carboxylic acids Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzyloxycarbonyl - Carbamic acid ester - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic homomonocyclic compound
• Descrizione: 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

Proprietà chimiche e fisiche

• Peso molecolare: 297.300 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 11
• Exact Mass: 297.121 Da
• Monoisotopic Mass: 297.121 Da
• Topological Polar Surface Area: 94.100 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 304.000
• 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