2-Hydroxy-4-(methacryloyloxy)benzophenone - ≥99% , CAS No.2035-72-5

CAS: 2035-72-5 Cat. No.: M465490 Molecular Weight: 282.29 EC Number: 218-000-6

GRADE & PURITY ≥99%

Synonyms

AKOS005395290 | UNII-T5DA43LN88 | CAA03572 | SCHEMBL212246 | 4-Methacryloxy-2-hydroxybenzophenone,min 99% | 4-METHACRYLOXY-2-HYDROXYBENZOPHENONE | T5DA43LN88 | AS-71101 | 2-Hydroxy-4-(methacryloyloxy)benzophenone | IMNBHNRXUAJVQE-UHFFFAOYSA-N | 4-Benzoyl-

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

Description

4-Methacryloxy-2-hydroxybenzophenone is a UV absorber that can be used in ophthamic and optical applications.

Specifications

Synonyms

AKOS005395290 | UNII-T5DA43LN88 | CAA03572 | SCHEMBL212246 | 4-Methacryloxy-2-hydroxybenzophenone, min 99% | 4-METHACRYLOXY-2-HYDROXYBENZOPHENONE | T5DA43LN88 | AS-71101 | 2-Hydroxy-4-(methacryloyloxy)benzophenone | IMNBHNRXUAJVQE-UHFFFAOYSA-N | 4-Benzoyl-

Specifications & Purity

≥99%

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥99%

Names and Identifiers

• Pubchem Sid: 504754873
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754873
• Canonical Smiles: CC(=C)C(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
• IUPAC Name: (4-benzoyl-3-hydroxyphenyl) 2-methylprop-2-enoate
• InChIKey: IMNBHNRXUAJVQE-UHFFFAOYSA-N
• INCHI: 1S/C17H14O4/c1-11(2)17(20)21-13-8-9-14(15(18)10-13)16(19)12-6-4-3-5-7-12/h3-10,18H,1H2,2H3
• Isomeric SMILES: CC(=C)C(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
• Molecular Weight: 282.29
• Reaxy-Rn: 1989369
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1989369&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Benzophenones

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Benzophenones
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzophenones
• Alternative Parents: Diphenylmethanes Aryl-phenylketones Phenol esters Phenoxy compounds Benzoyl derivatives 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Vinylogous acids Enoate esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzophenone - Aryl-phenylketone - Diphenylmethane - Phenol ester - Phenoxy compound - Benzoyl - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Vinylogous acid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organooxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
• 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.
• Sensitivity: light sensitive
• Flash Point(°F): Not applicable
• Flash Point(°C): Not applicable
• Melt Point(°C): 77-79°
• Molecular Weight: 282.290 g/mol
• XLogP3: 4.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 282.089 Da
• Monoisotopic Mass: 282.089 Da
• Topological Polar Surface Area: 63.600 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 409.000
• 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