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

CAS: 27813-02-1 Cat. No.: H109880 Summenformel: C₇H₁₂O₃ Molekulargewicht: 144.17 Beilstein Registry Number: 1752228 EG-Nummer: 248-666-3

QUALITÄT & REINHEIT ≥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

Spezifikationen

Synonyme

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

Spezifikationen & Reinheit

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

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%

Namen und Kennungen

Pubchem Sid

504752458

Pubchem Sid Url

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

Kanonisches Lächeln

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

Isomere SMILES

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

WGK Deutschland

1

RTECS

UD3442500

Molekulargewicht

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
    • Klasse Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Ebene5 Carboxylic acid esters
          • Ebene6 Alpha,beta-unsaturated carboxylic esters
            • Ebene7 Enoate esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: 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
• Beschreibung: 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

Zugehörige Ziele (menschlich)

AR Tclin Androgen Receptor (11781 Activities)

Discover Target: AR

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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Light sensitive
• Brechungsindex: 1.447
• Flammpunkt (°F): 203 °F
• Flammpunkt (°C): 95 °C
• Siedepunkt (°C): 57°C
• Molekulargewicht: 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