Ethylene glycol phenyl ether acrylate - ≥90%, contains stabilizer , CAS No.48145-04-6

CAS: 48145-04-6 Cat. No.: E102004 분자식: C₁₁H₁₂O₃ 분자량: 192.21 EC 번호: 256-360-6

GRADE & PURITY ≥90%, contains stabilizer

Synonyms

EINECS 256-360-6 | FT-0613283 | Ethylene glycol phenyl ether acrylate, 90%, contains 100ppm hydroquinone as inhibitor | 2-Phenoxyethanol acrylate | DTXSID4040715 | 2-Phenoxyethyl Acrylate (stabilized with MEHQ) | ETHYLENE GLYCOL MONOPHENYL ETHER MONOACRYL

Storage

Protected from light,Room temperature

Shipped In

Normal

Specifications

동의어

EINECS 256-360-6 | FT-0613283 | Ethylene glycol phenyl ether acrylate, 90%, contains 100ppm hydroquinone as inhibitor | 2-Phenoxyethanol acrylate | DTXSID4040715 | 2-Phenoxyethyl Acrylate (stabilized with MEHQ) | ETHYLENE GLYCOL MONOPHENYL ETHER MONOACRYL

사양 및 순도

≥90%, contains stabilizer

보관 조건

Protected from light,Room temperature

배송

Normal

순수함

≥90%

이름과 식별자

Pubchem Sid

504753589

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504753589

정식 스마일

C=CC(=O)OCCOC1=CC=CC=C1

IUPAC Name

2-phenoxyethyl prop-2-enoate

InChIKey

RZVINYQDSSQUKO-UHFFFAOYSA-N

INCHI

1S/C11H12O3/c1-2-11(12)14-9-8-13-10-6-4-3-5-7-10/h2-7H,1,8-9H2

이성체 SMILES

C=CC(=O)OCCOC1=CC=CC=C1

분자량

192.21

Reaxy-Rn

2102773

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2102773&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Phenol ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Phenol ethers
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenol ethers
• Alternative Parents: Phenoxy compounds Alkyl aryl ethers Acrylic acid esters Enoate esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Phenol ether - Alkyl aryl ether - Acrylic acid ester - Monocyclic benzene moiety - Acrylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
• 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

관련 대상(인간)

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

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

THRB Tclin Thyroid hormone receptor beta-1 (7926 Activities)

Discover Target: THRB

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

작용 메커니즘

화학 및 물리적 특성

• 용해성: Solubility in water: Practically insoluble; Very soluble in Ethanol,Ether
• 감도: Light Sensitive
• 굴절률: 1.518
• 발화점(°C): 113°C
• 끓는점(°C): 84°C
• 분자량: 192.210 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 192.079 Da
• Monoisotopic Mass: 192.079 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 183.000
• 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