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Basic Information
CAS No.: 25252-96-4
Name: 2-diethylaminoethyl 4-(prop-2-enoylamino)benzoate
Molecular Structure:
Molecular Structure of 25252-96-4 (2-diethylaminoethyl 4-(prop-2-enoylamino)benzoate)
Formula: C16H22 N2 O3
Molecular Weight: 290.40
Synonyms: Benzoicacid, 4-[(1-oxo-2-propenyl)amino]-, 2-(diethylamino)ethyl ester (9CI); Benzoicacid, p-acrylamido-, 2-(diethylamino)ethyl ester (8CI); Acryloylnovocaine;Acrylylprocaine
Density: 1.109g/cm3
Boiling Point: 460.1°Cat760mmHg
Flash Point: 232°C
Hazard Symbols: A poison.
Safety: A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx.
PSA: 58.64000
LogP: 2.38270
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Chemistry

Product Name: Procaine acryloyl monomer (CAS NO.25252-96-4)


Molecular Formula: C16H22N2O3
Molecular Weight: 290.40g/mol
Mol File: 25252-96-4.mol
Boiling point: 460.1 °C at 760 mmHg 
Flash Point: 232 °C
Density: 1.109 g/cm3
Surface Tension: 42.7 dyne/cm
Enthalpy of Vaporization: 72.07 kJ/mol
Vapour Pressure: 1.2E-08 mmHg at 25°C
XLogP3-AA: 2.4
H-Bond Donor: 1
H-Bond Acceptor: 4
Structure Descriptors of Procaine acryloyl monomer (CAS NO.25252-96-4):
  IUPAC Name: 2-diethylaminoethyl 4-(prop-2-enoylamino)benzoate
  Canonical SMILES: CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C=C
  InChI: InChI=1S/C16H22N2O3/c1-4-15(19)17-14-9-7-13(8-10-14)16(20)21-12-11-18(5-2)6-3/h4,7-10H,1,5-6,11-12H2,2-3H3,(H,17,19) 
  InChIKey: GDKWGGCUKNIXHY-UHFFFAOYSA-N

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 55mg/kg (55mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: DYSPNEA		 European Journal of Pharmacology. Vol. 114, Pg. 253, 1985.

Safety Profile

A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx.

Specification

 Procaine acryloyl monomer ,its CAS NO. is 25252-96-4,the synonyms is Acryloyl procaine monomer ; Acryloylnovocaine ; Acrylylprocaine ; p-Acrylamidobenzoic acid 2-(diethylamino)ethyl ester ; Benzoic acid, 4-((1-oxo-2-propenyl)amino)-, 2-(diethylamino)ethyl ester ; Benzoic acid, p-acrylamido-, 2-(diethylamino)ethyl ester (8CI) .