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2813-95-8

2813-95-8 structural image
Product Name: DINOSEB ACETATE
Formula: C12H14N2O6
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Boiling Point at 0.53kPa: 170 °C
Melting Point 26 - 27 °C
Flash Point >100 °C
Solubility 2.2 mg/mL at 25 °C
Vapor Density Relative vapor density (air = 1): 9.7
Vapor Pressure Vapor pressure, Pa at 20 °C: 0.08
Kovats Retention Index 1894 1908

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H319:Serious eye damage/eye irritation
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P201:Obtain special instructions before use.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P308+P313:IF exposed or concerned: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 282.25 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 282.08518617 g/mol
Monoisotopic Mass 282.08518617 g/mol
Topological Polar Surface Area 118 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 388
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Dinoseb acetate is a member of phenols and a benzoate ester.