3-(2-Methyl-2-Propanyl)Benzoyl Chloride
[CAS# 21900-36-7]

Identification

• Name: 3-(2-Methyl-2-Propanyl)Benzoyl Chloride
• Synonyms: 3-(tert-butyl)benzoyl chloride; 3-tert-Butylbenzoyl chloride; 3-TERT-BUTYLBENZOYLCHLORIDE
• Molecular Formula: C₁₁H₁₃ClO
• Molecular Weight: 196.67
• CAS Registry Number: 21900-36-7
• SMILES: CC(C)(C)c1cccc(c1)C(Cl)=O
• InChI: 1S/C11H13ClO/c1-11(2,3)9-6-4-5-8(7-9)10(12)13/h4-7H,1-3H3
• InChIKey: GYLMOVQXUVCWLK-UHFFFAOYSA-N

Properties

• Density: 1.077g/cm³ (Cal.)
• Boiling point: 250.256°C at 760 mmHg (Cal.)
• Flash point: 108.207°C (Cal.)
• Refractive index: 1.513 (Cal.)

Safety Data

• Safety Description: IRRITANT