2-Methyl-2-Propanyl 2-Chloro-4-Nitrobenzoate
[CAS# 250790-05-7]

Identification

• Name: 2-Methyl-2-Propanyl 2-Chloro-4-Nitrobenzoate
• Synonyms: BENZOIC ACID,2-CHLORO-4-NITRO-, 1,1-DIMETHYLETHYL ESTER
• Molecular Formula: C₁₁H₁₂ClNO₄
• Molecular Weight: 257.67
• CAS Registry Number: 250790-05-7
• SMILES: Clc1cc(ccc1C(=O)OC(C)(C)C)N(=O)=O
• InChI: 1S/C11H12ClNO4/c1-11(2,3)17-10(14)8-5-4-7(13(15)16)6-9(8)12/h4-6H,1-3H3
• InChIKey: AWGXKDKZWXJTFT-UHFFFAOYSA-N

Properties

• Density: 1.284g/cm³ (Cal.)
• Boiling point: 349.605°C at 760 mmHg (Cal.)
• Flash point: 165.235°C (Cal.)
• Refractive index: 1.544 (Cal.)