Hydroxypropyl methacrylate (HPMA) - ≥97%, stabilized with s0.02% 4-methoxyphenol , CAS No.27813-02-1

CAS: 27813-02-1 Cat. No.: H109880 Formule: C₇H₁₂O₃ Poids moléculaire: 144.17 Beilstein Registry Number: 1752228 Numéro CE: 248-666-3

QUALITÉ & PURETÉ ≥97%, stabilized with s0.02% 4-methoxyphenol

Synonyms

2-Hydroxypropylmethacrylate | 2-hydroxypropyl 2-methylprop-2-enoate

Storage

Store at 2-8°C

Shipped In

Wet ice

Spécifications

Synonymes

2-Hydroxypropylmethacrylate | 2-hydroxypropyl 2-methylprop-2-enoate

Spécifications et pureté

≥97%, stabilized with s0.02% 4-methoxyphenol

Conditions de stockage de stockage

Store at 2-8°C

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥97%

Noms et identifiants

Pubchem Sid

504752458

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752458

Sourires canoniques

CC(COC(=O)C(=C)C)O

IUPAC Name

2-hydroxypropyl 2-methylprop-2-enoate

InChIKey

VHSHLMUCYSAUQU-UHFFFAOYSA-N

INCHI

1S/C7H12O3/c1-5(2)7(9)10-4-6(3)8/h6,8H,1,4H2,2-3H3

Isomères SMILES

CC(COC(=O)C(=C)C)O

WGK Allemagne

1

RTECS

UD3442500

Poids moléculaire

144.17

Beilstein

1752228

Reaxy-Rn

1752228

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1752228&ln=

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 Alpha,beta-unsaturated carboxylic esters
            • Level7 Enoate esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid esters - Alpha,beta-unsaturated carboxylic esters
• Direct Parent: Enoate esters
• Alternative Parents: Secondary alcohols Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Enoate ester - Secondary alcohol - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as enoate esters. These are an alpha,beta-unsaturated carboxylic ester of general formula R1C(R2)=C(R3)C(=O)OR4 (R4= organyl compound) in which the ester C=O function is conjugated to a C=C double bond at the alpha,beta position.
• External Descriptors: enoate 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

Cibles associées (humaines)

AR Tclin Androgen Receptor (11781 Activities)

Discover Target: AR

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

Mécanismes d'action

Propriétés chimiques et physiques

• Sensibilité: Light sensitive
• Indice de réfraction: 1.447
• Point d'éclair (°F): 203 °F
• Point d'éclair (°C): 95 °C
• Point d'ébullition (°C): 57°C
• Poids moléculaire: 144.170 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 144.079 Da
• Monoisotopic Mass: 144.079 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 140.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1