Ethyl 2-[(3-Chloropropanoyl)Amino]-4,5,6,7-Tetrahydro-1-Benzothiophene-3-Carboxylate
[CAS# 60442-45-7]

Identification

• Name: Ethyl 2-[(3-Chloropropanoyl)Amino]-4,5,6,7-Tetrahydro-1-Benzothiophene-3-Carboxylate
• Synonyms: 1-Benzothiophene-3-carboxylic acid, 2-[(3-chloro-1-oxopropyl)amino]-4,5,6,7-tetrahydro-, ethyl ester; ethyl 2-(3-chloropropanoylamino)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxy late; ethyl 2-(3-chloropropanoylamino)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
• Molecular Formula: C₁₄H₁₈ClNO₃S
• Molecular Weight: 315.82
• CAS Registry Number: 60442-45-7
• SMILES: CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCCl
• InChI: 1S/C14H18ClNO3S/c1-2-19-14(18)12-9-5-3-4-6-10(9)20-13(12)16-11(17)7-8-15/h2-8H2,1H3,(H,16,17)
• InChIKey: NMBJUGPPCJLPQS-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 534.8±50.0°C at 760 mmHg (Cal.)
• Flash point: 277.2±30.1°C (Cal.)

Safety Data

• Safety Description: IRRITANT