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2019-69-4

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Basic Information
CAS No.: 2019-69-4
Name: MANDELIC ACID DIETHYLAMIDE
Article Data: 8
Molecular Structure:
Molecular Structure of 2019-69-4 (MANDELIC ACID DIETHYLAMIDE)
Formula: C12H17 N O2
Molecular Weight: 207.272
Synonyms: Mandelamide,N,N-diethyl- (7CI,8CI); 2-Hydroxy-2-phenyl-N,N-diethylacetamide;N,N-Diethyl-2-hydroxy-2-phenylacetamide; N,N-Diethyl-DL-mandelamide;N,N-Diethylmandelamide
Density: 1.085g/cm3
Boiling Point: 348.5°Cat760mmHg
Flash Point: 164.5°C
Safety: Moderately toxic by ingestion. A skin irritant. When heated to decomposition it emits toxic vapors of NOx.
PSA: 40.54000
LogP: 1.58840
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Chemistry

IUPAC Name: N,N-Diethyl-2-hydroxy-2-phenylacetamide
Synonyms of N,N-DiethyL-α-hydroxybenzene-acetamide (CAS NO.2019-69-4): 2-Hydroxy-2-phenyl-N,N-diethylacetamide ; Mandelamide, N,N-diethyl- ; N,N-Diethyl-alpha-hydroxybenzeneacetamide ; Benzeneacetamide, N,N-diethyl-alpha-hydroxy-
InChI: InChI=1/C12H17NO2/c1-3-13(4-2)12(15)11(14)10-8-6-5-7-9-10/h5-9,11,14H,3-4H2,1-2H3
InChIKey: UXLCWYBQDGCVQE-UHFFFAOYAO
Std. InChI: InChI=1S/C12H17NO2/c1-3-13(4-2)12(15)11(14)10-8-6-5-7-9-10/h5-9,11,14H,3-4H2,1-2H3
Std. InChIKey: UXLCWYBQDGCVQE-UHFFFAOYSA-N
CAS NO: 2019-69-4
Molecular Formula: C12H17NO2
Molecular Weight: 207.2689
Molecular Structure :
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 5
Polar Surface Area: 29.54 Å2
Index of Refraction: 1.537
Molar Refractivity: 59.62 cm3
Molar Volume: 190.9 cm3
Surface Tension: 43.1 dyne/cm
Density: 1.085 g/cm3
Flash Point: 164.5 °C
Enthalpy of Vaporization: 62.56 kJ/mol
Boiling Point: 348.5 °C at 760 mmHg
Vapour Pressure: 1.89E-05 mmHg at 25°C

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral 2222mg/kg (2222mg/kg)   National Technical Information Service. Vol. AD-A144-337,

Safety Profile

Moderately toxic by ingestion. A skin irritant. When N,N-DiethyL-α-hydroxybenzene-acetamide (CAS NO.2019-69-4) is heated to decomposition ,it emits toxic vapors of NOx.