3-Methylbutyl 2-[[(2E)-2-(Phenylmethylidene)Octylidene]Amino]Benzoate
[CAS# 72928-46-2]

Identification

• Name: 3-Methylbutyl 2-[[(2E)-2-(Phenylmethylidene)Octylidene]Amino]Benzoate
• Synonyms: Isopentyl 2-[[(2E)-2-(Phenylmethylene)Octylidene]Amino]Benzoate; 2-[[(2E)-2-(Phenylmethylene)Octylidene]Amino]Benzoic Acid Isopentyl Ester; 2-[[(E)-2-Hexyl-3-Phenyl-Prop-2-Enylidene]Amino]Benzoic Acid Isoamyl Ester
• Molecular Formula: C₂₇H₃₅NO₂
• Molecular Weight: 405.58
• CAS Registry Number: 72928-46-2
• EINECS: 277-075-3
• SMILES: C1=CC=C(C=C1)\C=C(C=NC2=C(C=CC=C2)C(=O)OCCC(C)C)/CCCCCC
• InChI: 1S/C27H35NO2/c1-4-5-6-8-15-24(20-23-13-9-7-10-14-23)21-28-26-17-12-11-16-25(26)27(29)30-19-18-22(2)3/h7,9-14,16-17,20-22H,4-6,8,15,18-19H2,1-3H3/b24-20+,28-21?
• InChIKey: LJVJMEOGMBKLKV-UTUOMVFDSA-N

Properties

• Density: 0.975g/cm³ (Cal.)
• Boiling point: 539.259°C at 760 mmHg (Cal.)
• Flash point: 174.324°C (Cal.)