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2-Phenoxyethyl butyrate is a chemical compound belonging to the class of phenoxyethanol esters. It is characterized by its colorless to light yellow liquid appearance, a citrus-like odor, and its insolubility in water. Known for its low toxicity, it is considered safe for use in cosmetics and personal care products when adhering to regulations and guidelines.

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  • 23511-70-8 Structure
  • Basic information

    1. Product Name: 2-Phenoxyethyl butyrate
    2. Synonyms: 2-phenoxyethyl butyrate;Butanoic acid, 2-phenoxyethyl ester;Butyric acid 2-phenoxyethyl ester
    3. CAS NO:23511-70-8
    4. Molecular Formula: C12H16O3
    5. Molecular Weight: 208.25
    6. EINECS: 245-705-6
    7. Product Categories: N/A
    8. Mol File: 23511-70-8.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 307.45°C (rough estimate)
    3. Flash Point: 112.3 ºC
    4. Appearance: /
    5. Density: 1.0388
    6. Vapor Pressure: 0.00398mmHg at 25°C
    7. Refractive Index: 1.5000 (estimate)
    8. Storage Temp.: 2-8°C
    9. Solubility: N/A
    10. CAS DataBase Reference: 2-Phenoxyethyl butyrate(CAS DataBase Reference)
    11. NIST Chemistry Reference: 2-Phenoxyethyl butyrate(23511-70-8)
    12. EPA Substance Registry System: 2-Phenoxyethyl butyrate(23511-70-8)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 23511-70-8(Hazardous Substances Data)

23511-70-8 Usage

Uses

Used in Personal Care and Cosmetic Industry:
2-Phenoxyethyl butyrate is used as a fragrance ingredient for its pleasant floral scent, enhancing the sensory experience of various personal care and cosmetic products.
Used in Food Industry:
2-Phenoxyethyl butyrate is used as a flavoring agent in food products, contributing to the overall taste and aroma profile, making it an essential component in the creation of food flavors.

Check Digit Verification of cas no

The CAS Registry Mumber 23511-70-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 2,3,5,1 and 1 respectively; the second part has 2 digits, 7 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 23511-70:
(7*2)+(6*3)+(5*5)+(4*1)+(3*1)+(2*7)+(1*0)=78
78 % 10 = 8
So 23511-70-8 is a valid CAS Registry Number.
InChI:InChI=1/C12H16O3/c1-2-6-12(13)15-10-9-14-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3

23511-70-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-phenoxyethyl butanoate

1.2 Other means of identification

Product number -
Other names butyric acid-(2-phenoxy-ethyl ester)

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only. Food additives -> Flavoring Agents
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:23511-70-8 SDS

23511-70-8Downstream Products

23511-70-8Relevant articles and documents

Reestimation of the Taft's substituent constant of the pentafluorophenyl group

Korenaga, Toshinobu,Kadowaki, Koichi,Ema, Tadashi,Sakai, Takashi

, p. 7340 - 7343 (2007/10/03)

The Taft's substituent constant of the pentafluorophenyl group (σ*C6F5)) was reestimated to be 1.50 by correlation between IR spectral data (vC=O) and σ* constants for a series of esters (involving the pentafluorobenzyl group) of 3-phenylpropanoic acid and butanoic acid. The possibility of the disturbance of the correlation by the intramolecular π-π interaction between C 6F5 and C6H5 groups in pentafluorobenzyl 3-phenylpropanoate was excluded by ab initio and DFT calculations of the stable conformations and their carbonyl frequencies. The reestimated σ* (C6F5) value was used for calculation of the pKa value of pentafluorobenzyl alcohol [14.5 (or 14.3)].

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