ChemicalBook--->CAS DataBase List--->94-47-3

94-47-3

94-47-3 Structure

94-47-3 Structure
IdentificationBack Directory
[Name]

FEMA 2860
[CAS]

94-47-3
[Synonyms]

FEMA 2860
Phenethylbenzoat
PHENYLETHYLBENZOAT
PHENETHYL BENZOATE
PHENYLETHYL BENZOATE
2-Phenethyl benzoate
2-phenylethylbenzoate
2-Phenylethyl benzoate
benzylcarbinylbenzoate
B-PHENYLETHYL BENZOATE
Benzoic acid phenethyl
beta-Phenethyl benzoate
Benzylcarbinyl benzoate
PHENETHYL BENZOATE 99+%
PHENETHYL BENZOATE, 98+%
phenethylalcohol,benzoate
BETA PHENYL ETHYL BENZOATE
Phenethyl alcohol, benzoate
BENZOIC ACID PHENETHYL ESTER
Benzoicacid,2-phenylethylester
2-fenylethylesterkyselinybenzoove
2-Fenylethylester kyseliny benzoove
[EINECS(EC#)]

202-336-5
[Molecular Formula]

C15H14O2
[MDL Number]

29163100
[MOL File]

94-47-3.mol
[Molecular Weight]

226.27
Chemical PropertiesBack Directory
[Appearance]

Clear colorless liquid
[Boiling point ]

182 °C12 mm Hg(lit.)
[density ]

1.093 g/mL at 25 °C(lit.)
[vapor pressure ]

0.015Pa at 25℃
[FEMA ]

2860 | PHENETHYL BENZOATE
[refractive index ]

n20/D 1.56(lit.)
[Fp ]

>230 °F
[form ]

Liquid
[color ]

Clear colorless
[Odor]

at 100.00 %. soft rose balsam honey floral
[Odor Type]

floral
[Water Solubility ]

207.21mg/L at 25℃
[LogP]

3.815 at 25℃
[CAS DataBase Reference]

94-47-3
[EPA Substance Registry System]

Benzoic acid, 2-phenylethyl ester (94-47-3)
Hazard InformationBack Directory
[Chemical Properties]

Clear colorless liquid
[Occurrence]

Reported found in the essential oil from flowers of rose and orange, in bilberry, cinnamon leaf, cassia leaf, malay apple and sea buckthorn.
[Uses]

Phenethyl Benzoate is a building block used in the synthetic preparation of esters using Bi(OTf)3 catalyzed acylation of alcohols with acid anhydrides.
[Definition]

ChEBI: Phenethyl benzoate is a benzoate ester resulting from the formal condensation of the carboxy group of benzoic acid with the hydroxy group of 2-phenylethanol. It has a role as a plant metabolite and a volatile oil component. It is functionally related to a benzoic acid and a 2-phenylethanol.
[Preparation]

From phenethyl alcohol and benzoyl chloride in the presence of NaOH; from phenylethyl alcohol and methylbenzoate; by esterification of phenylethyl acohol with benzoic acid.
[Flammability and Explosibility]

Notclassified
[Metabolism]

The metabolism of benzoic acid has been extensively studied in more than 20 species, including man (Williams, 1959). Depending on species and other factors, such as availability of glycine, benzoic acid may be excreted in the urine as hippuric acid, benzoyl glucuronide or other compounds (see, for example, Bridges. French. Smith & Williams, 1970; Irjala, 1972; Kato, 1972; Martin, 1966; Runyan, 1971; Strahl & Barr, 1971; Wan & Riegelman, 1972). The major route of biotransformation of benzoic acid in man is conjugation with glycine to form hippuric acid, the rate-limiting factor in this reaction being the availability of glycine (Amsel & Levy. 1969). In man at a dose of 1 mg/kg, benzoic acid is excreted entirely as hippuric acid (Bridges et al. 1970). Phenylethyl alcohol is oxidized almost entirely to phenylacetic acid (Williams, 1959). In rabbits, a small amount of benzoic acid is also formed; the phenylacetic acid is excreted mainly as phenaceturic acid (Smith, Smithies & Williams, 1954).
Safety DataBack Directory
[WGK Germany ]

2
[RTECS ]

DH6288000
[HS Code ]

29163100
[Toxicity]

The acute oral LD50 in rats was reported to be 5 g/kg and the acute dermal LD50 in rabbits exceeded 5 g/kg (Wohl 1974).
Spectrum DetailBack Directory
[Spectrum Detail]

FEMA 2860(94-47-3)FT-IR
94-47-3 suppliers list
Company Name: Shandong Juchuang Chemical Co., LTD
Tel: +undefined15030412209 , +undefined15030412209
Website:
Company Name: Henan Tianfu Chemical Co.,Ltd.
Tel: +86-0371-55170693 +86-19937530512 , +86-19937530512
Website: https://www.tianfuchem.com/
Company Name: career henan chemical co
Tel: +86-0371-86658258
Website: https://www.coreychem.com/
Company Name: Hubei xin bonus chemical co. LTD
Tel: 86-13657291602
Website: www.chemicalbook.com/ShowSupplierProductsList1549548/0.htm
Company Name: Shaanxi Dideu Medichem Co. Ltd
Tel: 18192627656 , 18192627656
Website: https://www.chemicalbook.com/manufacturer/shaanxi-dideu-medichem-219/
Company Name: Neostar United (Changzhou) Industrial Co., Ltd.
Tel: +86-519-519-85557386
Website: http://www.neostarunited.com
Company Name: SIMAGCHEM CORP
Tel: +86-13806087780 , +86-13806087780
Website: http://www.simagchem.com/
Company Name: Shanghai UCHEM Inc.
Tel: +862156762820 +86-13564624040 , +86-13564624040
Website: http://www.myuchem.com/
Company Name: Dideu Industries Group Limited
Tel: +86-29-89586680 +86-15129568250 , +86-15129568250
Website: www.dideu.com
Company Name: sgtlifesciences pvt ltd
Tel: +8617013299288 , +8617013299288
Website: https://www.chemicalbook.com/ShowSupplierProductsList1846349/0.htm
Company Name: Alfa Chemistry
Tel: +1-5166625404
Website: https://www.alfa-chemistry.com/
Company Name: Changzhou AniKare Pharmatech Co., Ltd.
Tel: +86-0519-8359-8696 +8618018249389 , +8618018249389
Website: http://www.anikare.cn/index_en.html
Company Name: LEAPCHEM CO., LTD.
Tel: +86-852-30606658
Website: www.leapchem.com
Company Name: Shanghai Acmec Biochemical Technology Co., Ltd.
Tel: +undefined18621343501 , +undefined18621343501
Website: www.acmec.com.cn/
Company Name: Arpan Aromatics  
Tel: +91-9824514546 +91-9824029204
Website: www.arpanaromatics.com
Company Name: Garuda Chemicals  
Tel: +91-8097853976 +91-8097853975
Website: www.garudachem.com
Company Name: Flowersynth  
Tel: +91-9845115120 +91-9886340888
Website: www.flowersynth.com
Company Name: HJ AROCHEM  
Tel: +91-8690768060 +91-9724420086
Website: www.hjarochem.com
Tags:94-47-3 Related Product Information
67604-48-2 1257-08-5 485-49-4 989-51-5