2-[2-(4-Chlorophenoxy)-2-Methylpropionyloxy]Ethyl Nicotinate Hydrochloride
[CAS# 56775-91-8]

Identification

• Name: 2-[2-(4-Chlorophenoxy)-2-Methylpropionyloxy]Ethyl Nicotinate Hydrochloride
• Synonyms: 2-[2-(4-Chlorophenoxy)-2-Methyl-Propanoyl]Oxyethyl Pyridine-3-Carboxylate Hydrochloride; 3-Pyridinecarboxylic Acid 2-[2-(4-Chlorophenoxy)-2-Methyl-1-Oxopropoxy]Ethyl Ester Hydrochloride; Nicotinic Acid 2-[2-(4-Chlorophenoxy)-2-Methyl-Propanoyl]Oxyethyl Ester Hydrochloride
• Molecular Formula: C₁₈H₁₉Cl₂NO₅
• Molecular Weight: 400.26
• CAS Registry Number: 56775-91-8
• EINECS: 260-377-4
• SMILES: [H+].C2=C(OC(C)(C)C(OCCOC(=O)C1=CN=CC=C1)=O)C=CC(=C2)Cl.[Cl-]
• InChI: 1S/C18H18ClNO5.ClH/c1-18(2,25-15-7-5-14(19)6-8-15)17(22)24-11-10-23-16(21)13-4-3-9-20-12-13;/h3-9,12H,10-11H2,1-2H3;1H
• InChIKey: SMQMWHHMXSBKEP-UHFFFAOYSA-N

Properties

• Boiling point: 486.8°C at 760 mmHg (Cal.)
• Flash point: 248.2°C (Cal.)