Cyclohexyl methacrylate (CHMA) - ≥98%,contains MEHQ as inhibitor , CAS No.101-43-9

CAS: 101-43-9 Cat. No.: C102351 Formula: C₁₀H₁₆O₂ Molecular Weight: 168.23 Beilstein Registry Number: 2045235 EC Number: 202-943-5

GRADE & PURITY ≥98%, contains MEHQ as inhibitor

Synonyms

AKOS015915456 | Cyclohexyl methacrylate, contains 60 - 100 ppm MEHQ as stabilizer, 98% | HSDB 5340 | EC 202-943-5 | 2-Propenoic acid, 2-methyl-, cyclohexyl ester | FT-0624206 | Cyclohexyl 2-methylacrylate # | UNII-5L9UUV9T6Q | Cyclohexyl methacrylate, mon

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

AKOS015915456 | Cyclohexyl methacrylate, contains 60 - 100 ppm MEHQ as stabilizer, 98% | HSDB 5340 | EC 202-943-5 | 2-Propenoic acid, 2-methyl-, cyclohexyl ester | FT-0624206 | Cyclohexyl 2-methylacrylate # | UNII-5L9UUV9T6Q | Cyclohexyl methacrylate, mon

Specifications & Purity

≥98%,contains MEHQ as inhibitor

Storage

Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

Pubchem Sid

488180482

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180482

Canonical Smiles

CC(=C)C(=O)OC1CCCCC1

IUPAC Name

cyclohexyl 2-methylprop-2-enoate

InChIKey

OIWOHHBRDFKZNC-UHFFFAOYSA-N

INCHI

1S/C10H16O2/c1-8(2)10(11)12-9-6-4-3-5-7-9/h9H,1,3-7H2,2H3

Isomeric SMILES

CC(=C)C(=O)OC1CCCCC1

WGK Germany

1

Molecular Weight

168.23

Beilstein

2045235

Reaxy-Rn

2045235

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2045235&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class 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
• Class: 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: Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Enoate ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic 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: 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

Chemical and Physical Properties

• Solubility: Insoluble in water
• Refractive Index: 1.458
• Flash Point(°C): 78 °C
• Boil Point(°C): 68-70°C/4mmHg
• Molecular Weight: 168.230 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 168.115 Da
• Monoisotopic Mass: 168.115 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 178.000
• 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