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Name | (Z)-But-2-Ene-1,2,3-Tricarboxylic Acid |
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Molecular Structure | ![]() |
Molecular Formula | C27H29BrCl2N2O7 |
Molecular Weight | 644.35 |
CAS Registry Number | 6061-93-4 |
SMILES | C1=C(O)C=C(OC)C(=C1OC)C2C5(Cl)C(Cl)(CC3C4C(CC=C23)C(=O)N(C4=O)C(C)(C)C)C(=O)N(C5=O)CBr |
InChI | 1S/C27H29BrCl2N2O7/c1-25(2,3)32-21(34)14-7-6-13-15(18(14)22(32)35)10-26(29)23(36)31(11-28)24(37)27(26,30)20(13)19-16(38-4)8-12(33)9-17(19)39-5/h6,8-9,14-15,18,20,33H,7,10-11H2,1-5H3 |
InChIKey | CFZIHKALHXEGBL-UHFFFAOYSA-N |
Desity | 1.62g/cm3 (Cal.) |
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Boiling point | 788.944°C at 760 mmHg (Cal.) |
Flash point | 430.938°C (Cal.) |
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