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83834-59-7

83834-59-7 structural image
Product Name: 4-METHOXYCINNAMIC ACID 2-ETHYLHEXYL ESTER
Formula: C18H26O3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description 2-ethylhexyl p-methoxycinnamate is a colorless to pale yellow viscous liquid. (NTP, 1992)
Color/Form Pale yellow liquid
Odor Practically odorless
Boiling Point 388 to 392 °F at 3 mmHg (NTP, 1992)
Melting Point less than -13 °F (NTP, 1992)
Solubility less than 1 mg/mL at 81 °F (NTP, 1992)
Density 1.01 to 1.02 at 68 °F (NTP, 1992)
Vapor Pressure 0.000014 [mmHg]
LogP 5.8
Stability/Shelf Life Stable under recommended storage conditions.
Kovats Retention Index 2339
Other Experimental Properties log Kow: >6 at 23 C OECD Guideline 117 (Partition Coefficient (n-octanol / water), HPLC Method)
Chemical Classes Other Uses -> Sunscreens

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P271:Use only outdoors or in a well-ventilated area.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 290.4 g/mol
XLogP3 5.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 10
Exact Mass 290.18819469 g/mol
Monoisotopic Mass 290.18819469 g/mol
Topological Polar Surface Area 35.5 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 304
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

2-ethylhexyl p-methoxycinnamate is a colorless to pale yellow viscous liquid. (NTP, 1992)