3-Thiophenecarboxylic acid, 2-amino-4-(4-chlorophenyl)-5-methyl-, ethyl ester

Chemical Properties

Melting point	92-95℃
Boiling point	411.2±45.0 °C(Predicted)
Density	1.291±0.06 g/cm3(Predicted)
pka	0.03±0.14(Predicted)
form	solid
InChI	1S/C14H14ClNO2S/c1-3-18-14(17)12-11(8(2)19-13(12)16)9-4-6-10(15)7-5-9/h4-7H,3,16H2,1-2H3
InChIKey	PJCFNTKRSCPMFG-UHFFFAOYSA-N
SMILES	NC(S1)=C(C(OCC)=O)C(C2=CC=C(Cl)C=C2)=C1C

Hazard Codes	Xi
WGK Germany	WGK 3
HazardClass	IRRITANT
Storage Class	11 - Combustible Solids
Hazard Classifications	Acute Tox. 4 Oral Aquatic Chronic 4

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