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3,5,5-Trimethylhexyl acrylate - 90%（20-120 ppm MEHQ as inhibitor）, high purity , CAS No.45125-03-9

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3,5,5-Trimethylhexyl acrylate - 90%（20-120 ppm MEHQ as inhibitor）, high purity , CAS No.45125-03-9

5 Citations

COA

Grade & Purity:

≥90%
20-120 ppm MEHQ as inhibitor

Cas Number: 45125-03-9
Molecular Weight: 198.31
MDL number: MFCD00080661
PubChem CID: 4391003

In stock

Item Number

T476820

Grouped product items
SKU	Size	Availability	Price
T476820-1ml	1ml	2	$22.90
T476820-5ml	5ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$67.90
T476820-25ml	25ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$237.90

View related series

Fatty chain compounds (194)

Basic Description

Synonyms	3,5,5-trimethylhexylacrylate \| AM10874 \| 2-Propenoic acid, 3,5,5-trimethylhexyl ester \| DTXSID50402772 \| AS-66468 \| 3,5,5-Trimethylhexyl acrylate \| MFCD00080661 \| AKOS025295341 \| F71606 \| VBA12503 \| SCHEMBL231256 \| 3,5,5-trimethylhexyl Prop-2-enoate \| 3,5
Specifications & Purity	≥90%, 20-120 ppm MEHQ as inhibitor
Storage Temp	Store at 2-8°C,Protected from light
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Acrylic acids and derivatives

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Acrylic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Acrylic acid esters
Alternative Parents	Enoate esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic acyclic compounds
Substituents	Acrylic acid ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as acrylic acid esters. These are organic compounds containing and ester acrylic acid (CH2=CHC(=O)OH).
External Descriptors	Not available
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

Names and Identifiers

IUPAC Name	3,5,5-trimethylhexyl prop-2-enoate
INCHI	InChI=1S/C12H22O2/c1-6-11(13)14-8-7-10(2)9-12(3,4)5/h6,10H,1,7-9H2,2-5H3
InChIKey	FIXKCCRANLATRP-UHFFFAOYSA-N
Smiles	CC(CCOC(=O)C=C)CC(C)(C)C
Isomeric SMILES	CC(CCOC(=O)C=C)CC(C)(C)C
WGK Germany	3
PubChem CID	4391003
Molecular Weight	198.31

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number	Certificate Type	Date	Item
D2428585	Certificate of Analysis	Apr 12, 2024	T476820
D2428583	Certificate of Analysis	Apr 12, 2024	T476820
D2428584	Certificate of Analysis	Apr 12, 2024	T476820
D2428587	Certificate of Analysis	Apr 12, 2024	T476820
D2428586	Certificate of Analysis	Apr 12, 2024	T476820
D2428588	Certificate of Analysis	Apr 12, 2024	T476820

Chemical and Physical Properties

Sensitivity	Light sensitive；Moisture sensitive
Refractive Index	n20/D 1.437 (lit.)
Flash Point(°F)	192.2 °F
Flash Point(°C)	89 °C
Boil Point(°C)	55 °C/0.4 mmHg (lit.)
Melt Point(°C)	−34 °C (lit.)
Molecular Weight	198.300 g/mol
XLogP3	4.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Exact Mass	198.162 Da
Monoisotopic Mass	198.162 Da
Topological Polar Surface Area	26.300 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	189.000
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

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Cong Ma, Yishuo Wu, Meina Yu, Yanzi Gao, Jiumei Xiao, Cheng Zou, Huai Yang. (2023) Effect of Liquid Crystalline Acrylates on the Electro-Optical Properties and Micro-Structures of Polymer-Dispersed Liquid Crystal Films. Crystals, 13 (9): (1294).
2. Jianjun Xu, Meina Yu, Gang Chen, Xiao Wang, Junmei Hu, Cheng Zou, Qian Wang, Jiumei Xiao, Yanzi Gao, Siquan Zhu, Huai Yang. (2022) Study on the preparation and performance of an electrically controlled dimming film with wide working temperature range. JOURNAL OF MOLECULAR LIQUIDS, 367 (120408).
3. Meina Yu, Jianjun Xu, Tianyang Wang, Luoning Zhang, Huiyun Wei, Cheng Zou, Yanzi Gao, Huai Yang. (2022) Effects of acrylate monomers with different alkyl chain structure on the electro-optical properties and microstructure of polymer dispersed liquid crystals. JOURNAL OF APPLIED POLYMER SCIENCE, 139 (43): (e53056).
4. Meina Yu, Tianyang Wang, Jianjun Xu, Wei Hu, Yanzi Gao, Cheng Zou, Huai Yang. (2022) Steric group-based polymer dispersed liquid crystal composite films with high contrast ratio, low driving voltage and small hysteresis. JOURNAL OF MOLECULAR LIQUIDS, 365 (120152).
5. Cong Ma, Zuowei Zhang, Yihai Yang, Peixiang Wang, Meina Yu, Yanzi Gao, Qian Wang, Jiumei Xiao, Cheng Zou, Huai Yang. (2024) A Smart Window with Passive Radiative Cooling and Switchable Near-Infrared Light Transmittance via Molecular Engineering. ACS Applied Materials & Interfaces, 16 (19): (25343-25352).

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