Poly(vinyl acetate)（PVAC） - approx. M.W. 100000 , CAS No.9003-20-7

CAS: 9003-20-7 Cat. No.: P304876 Formula: [CH₂CHCOOCH₃]n Numero EC: 618-358-7

GRADE & PURITY approx. M.W. 100000

Synonyms

AKOS009120081 | Vinyl ethanoate | Vinyle (acetate de) | Acetic acid vinyl ester | CH3CO2CH=CH2 | Ethanoic acid, ethenyl ester | VINYL ACETATE (IARC) | NCGC00258371-01 | Vinyl acetate, inhibited | Acetic acid ethenyl ester | Vinile | Vinnapas A 50 | Acetic

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

AKOS009120081 | Vinyl ethanoate | Vinyle (acetate de) | Acetic acid vinyl ester | CH3CO2CH=CH2 | Ethanoic acid, ethenyl ester | VINYL ACETATE (IARC) | NCGC00258371-01 | Vinyl acetate, inhibited | Acetic acid ethenyl ester | Vinile | Vinnapas A 50 | Acetic

Specifiche e purezza

approx. M.W. 100000

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Nomi e identificatori

Pubchem Sid

508816153

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508816153

Sorrisi canonici

COC(=O)C=C

IUPAC Name

ethenyl acetate

InChIKey

XTXRWKRVRITETP-UHFFFAOYSA-N

INCHI

1S/C4H6O2/c1-3-6-4(2)5/h3H,1H2,2H3

Isomeri SMILES

CC(=O)OC=C

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid esters
          • Level6 Enol esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid esters
• Direct Parent: Enol esters
• Alternative Parents: Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Enol ester - Monocarboxylic acid or derivatives - 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 enol esters. These are ester derivatives of enols. They have the general formula RC=COC(=O)R' where R, R' = H or organyl group.
• External Descriptors: acetate ester

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

Obiettivi associati (umani)

PPARG Tclin Peroxisome proliferator-activated receptor gamma (15191 Activities)

Discover Target: PPARG

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Lymphoblastoid cell (5959 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Obiettivi associati (non umani)

Ppard Peroxisome proliferator-activated receptor delta (358 Activities)

Discover Target: Ppard

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Peso molecolare: 86.090 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 86.0368 Da
• Monoisotopic Mass: 86.0368 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 65.900
• 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