CAS No.48145-04-6,2-PHENOXYETHYL ACRYLATE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	48145-04-6
Name:	2-PHENOXYETHYL ACRYLATE
Article Data:	6

Formula:	C₁₁H₁₂O₃
Molecular Weight:	192.214
Synonyms:	AMP 10G;Ageflex PEA;EM 210;Ebecryl 114;Eternal PEA;Ethylene glycol monophenyl ether monoacrylate;Ethylene glycolphenyl ether acrylate;GX 8079;IRR 169;Kayarad R 561;Laromer POEA;Light Ester PO-A;NK Ester AMP 10G;Photomer 4035;SR 339;SR 339A;Sartomer 339;Sartomer SR 339;Viscoat 192;
EINECS:	256-360-6
Density:	1.079 g/cm³
Boiling Point:	295.3 °C at 760 mmHg
Flash Point:	119.7 °C
Solubility:	525mg/L at 25℃
Hazard Symbols:	Xi, N
Risk Codes:	36/37/38-51/53
Safety:	26-28-61
PSA:	35.53000
LogP:	1.79460

Synthetic route

: 122-99-6
2-Phenoxyethanol

: 292638-85-8
acrylic acid methyl ester

: 48145-04-6
2-phenoxyethyl acrylate

Conditions

Conditions	Yield
With dmap; oxo[hexa(trifluoroacetato)]tetrazinc In neat (no solvent) at 80℃; for 24h; Inert atmosphere; Schlenk technique; chemoselective reaction;	99%
With toluene-4-sulfonic acid; hydroquinone Entfernen des entstehenden Methanols;
With sulfuric acid; hydroquinone Entfernen des entstehenden Methanols;

: 122-99-6
2-Phenoxyethanol

: 814-68-6
acryloyl chloride

: 48145-04-6
2-phenoxyethyl acrylate

Conditions

Conditions	Yield
at 0℃; for 8h;	90%
With copper(I) chloride; sodium carbonate In benzene

: 122-99-6
2-Phenoxyethanol

: 140-88-5
ethyl acrylate

: 48145-04-6
2-phenoxyethyl acrylate

Conditions

Conditions	Yield
With sulfuric acid; hydroquinone Entfernen des entstehenden Aethanols;
With toluene-4-sulfonic acid; hydroquinone Entfernen des entstehenden Aethanols;

: 122-99-6
2-Phenoxyethanol

: 497-19-8
sodium carbonate

: 814-68-6
acryloyl chloride

: 48145-04-6
2-phenoxyethyl acrylate

Conditions

Conditions	Yield
copper(I) chloride In benzene

...Expand

: 48145-04-6
2-phenoxyethyl acrylate

: 2465-65-8
O,O'-diethyl thiophosphoric acid

: 3-(diethoxy-phosphorylsulfanyl)-propionic acid 2-phenoxy-ethyl ester

Conditions

Conditions	Yield
With 4-methoxy-phenol at 90℃; for 1h; Michael addition;	97%

: 591-50-4
iodobenzene

: 48145-04-6
2-phenoxyethyl acrylate

: 90094-75-0
1-(3-phenyl-2-propenoyloxy)-2-phenoxyethane

Conditions

Conditions	Yield
With triethylamine; poly{bis[(N-iPr-acrylamide)5-co-((4-vinylphenyl)PPh2)]PdCl2} In toluene at 100℃; for 20h; Heck reaction;	97%

: 4486-44-6
O,O-diisopropylphosphorothioic acid

: 48145-04-6
2-phenoxyethyl acrylate

: 3-(diisopropoxy-phosphorylsulfanyl)-propionic acid 2-phenoxy-ethyl ester

Conditions

Conditions	Yield
With 4-methoxy-phenol at 90℃; for 1h; Michael addition;	96%

: 603-76-9
1-methylindole

: 48145-04-6
2-phenoxyethyl acrylate

: 1276027-75-8
2-phenoxyethyl 3-(1-methyl-1H-indol-3-yl)propanoate

Conditions

Conditions	Yield
With indium(III) bromide In 1,2-dichloro-ethane at 80℃; for 12h; Michael addition; Inert atmosphere; regioselective reaction;	93%

: 48145-04-6
2-phenoxyethyl acrylate

: 1422263-05-5
2-phenoxyethyl 2-iodoacrylate

Conditions

Conditions	Yield
With N-iodophthalimide; 3-quinuclidinol In acetonitrile at 20℃; for 24h; Darkness; chemoselective reaction;	93%

: 70-49-5
DL-thiomalic acid

: 48145-04-6
2-phenoxyethyl acrylate

: C15H18O7S

Conditions

Conditions	Yield
With triethylamine In acetonitrile at 20℃; for 1h;	81%

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Consensus Reports

Reported in EPA TSCA Inventory.

Specification

The IUPAC name of Phenyl cellosolve acrylate is 2-phenoxyethyl prop-2-enoate. With the CAS registry number 48145-04-6, it is also named as 2-Propenoic acid, 2-phenoxyethyl ester. The other registry numbers are 329327-80-2 and 93615-54-4. The classification code is Skin / Eye Irritant. When heated to decomposition it emits acrid smoke and irritating fumes. In addition, this chemical is liquid which should be sealed in the container and stored in the cool and dry place.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 2.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.71; (4)ACD/LogD (pH 7.4): 2.71; (5)ACD/BCF (pH 5.5): 67.61; (6)ACD/BCF (pH 7.4): 67.61; (7)ACD/KOC (pH 5.5): 710.43; (8)ACD/KOC (pH 7.4): 710.43; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Index of Refraction: 1.506; (13)Molar Refractivity: 52.96 cm³; (14)Molar Volume: 178 cm³; (15)Polarizability: 20.99×10^-24 cm³; (16)Surface Tension: 36.2 dyne/cm; (17)Enthalpy of Vaporization: 53.5 kJ/mol; (18)Vapour Pressure: 0.00153 mmHg at 25°C; (19)Rotatable Bond Count: 6; (20)Exact Mass: 192.078644; (21)MonoIsotopic Mass: 192.078644; (22)Topological Polar Surface Area: 35.5; (23)Heavy Atom Count: 14; (24)Complexity: 183.

Uses of Phenyl cellosolve acrylate: It can react with 2H-pyridine-1-carboxylic acid methyl ester to get 2-aza-bicyclo[2.2.2]oct-7-ene-2,6-dicarboxylic acid 2-methyl ester 6-(2-phenoxy-ethyl) ester and 2-aza-bicyclo[2.2.2]oct-7-ene-2,6-dicarboxylic acid 2-methyl ester 6-(2-phenoxy-ethyl) ester. This Diels-Alder reaction reacts at temperature of 160 °C. The reaction time is 15 hours and the yield is 22%.

When you are using this chemical, please be cautious about it as the following:
It is not only irritating to eyes, respiratory system and skin, but also toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. After contact with skin, wash immediately with plenty of soap-suds. So people should avoid release it to the environment. Refer to special instructions / safety data sheets.

People can use the following data to convert to the molecule structure.
1. SMILES:O=C(OCCOc1ccccc1)\C=C
2. InChI:InChI=1/C11H12O3/c1-2-11(12)14-9-8-13-10-6-4-3-5-7-10/h2-7H,1,8-9H2
3. InChIKey:RZVINYQDSSQUKO-UHFFFAOYAG

The following are the toxicity data which has been tested.

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	oral	4500mg/kg (4500mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)	Meditsina Truda i Promyshlennaya Ekologiya. Industrial Medicine and Ecology. Vol. (7), Pg. 37, 1994.
rabbit	LD50	skin	2540uL/kg (2.54mL/kg)		Union Carbide Data Sheet. Vol. 10/4/1977,
rat	LD50	intraperitoneal	900mg/kg (900mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)	Meditsina Truda i Promyshlennaya Ekologiya. Industrial Medicine and Ecology. Vol. (7), Pg. 37, 1994.
rat	LD50	oral	4660uL/kg (4.66mL/kg)		Union Carbide Data Sheet. Vol. 10/4/1977,