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EC number: 271-176-6 | CAS number: 68516-73-4
Reference substances
- IUPAC name:
- tetramethyl 2,2'-{1,4-phenylenebis[imino(1,3-dioxobutane-2,1-diyl)diazene-2,1-diyl]}diterephthalate
Inventory
- EC number:
- 271-176-6
- EC name:
- Tetramethyl 2,2'-[1,4-phenylenebis[imino(1-acetyl-2-oxoethane-1,2-diyl)azo]]bisterephthalate
- CAS number:
- 68516-73-4
- CAS number:
- 68516-73-4
Synonyms
- Names:
- 1,4-Benzenedicarboxylic acid, 2,2'-[1,4-phenylenebis[imino( 1-acetyl-2-oxo-2,1-ethanediyl)azo]]bis-, tetramethyl ester
- 1,4-Benzenedicarboxylic acid, 2,2'-[1,4-phenylenebis[imino(1-acetyl-2-oxo-2,1-ethanediyl)azo]]bis-,
- 1,4-Benzenedicarboxylic acid, 2,2'-[1,4-phenylenebis[imino(1-acetyl-2-oxo-2,1-ethanediyl)azo]]bis-, tetramethyl ester
- Identifier:
- IUPAC name
- Tetramethyl 2,2'-[1,4-phenylenebis[imino(1-acetyl-2-oxoethane-1,2-diyl)azo]]bisterephthalate
- Identifier:
- IUPAC name
- tetramethyl 2,2'-{1,4-phenylenebis[imino(1,3-dioxobutane-2,1-diyl) diazene-2,1-diyl]}diterephthalate
- Identifier:
- other: InChl
- InChI=1S/C34H32N6O12/c1-17(41)27(39-37-25-15-19(31(45)49-3)7-13-23(25)33(47)51-5)29(43)35-21-9-11-22(12-10-21)36-30(44)28(18(2)42)40-38-26-16-20(32(46)50-4)8-14-24(26)34(48)52-6/h7-16,27-28H,1-6H3,(H,35,43)(H,36,44)/b39-37+,40-38+
- Identifier:
- other: SMILES notation
- COC(=O)c3cc(N=NC(=O)C(Nc1ccc(cc1)NC(C(=O)N=Nc2cc(ccc2C(=O)OC)C(=O)OC)C(C)=O)C(C)=O)c(cc3)C(=O)OC
- Identifier:
- other: InChl
- InChI=1/C34H32N6O12/c1-17(41)27(29(43)39-37-25-15-19(31(45)49-3)7-13-23(25)33(47)51-5)35-21-9-11-22(12-10-21)36-28(18(2)42)30(44)40-38-26-16-20(32(46)50-4)8-14-24(26)34(48)52-6/h7-16,27-28,35-36H,1-6H3
- Identifier:
- other: SMILES notation
- O=C(C(N=Nc1cc(ccc1C(=O)OC)C(=O)OC)C(=O)C)Nc1ccc(cc1)NC(=O)C(N=Nc1c(ccc(c1)C(=O)OC)C(=O)OC)C(=O)C
Molecular and structural information
- Molecular formula:
- C34H32N6O12
- Molecular weight:
- 716.651
- SMILES notation:
- CC(=O)C(/N=N/c1c(ccc(c1)C(=O)OC)C(=O)OC)C(=O)Nc2ccc(cc2)NC(=O)C(/N=N/c3c(ccc(c3)C(=O)OC)C(=O)OC)C(=O)C
- InChl:
- InChI=1S/C34H32N6O12/c1-17(41)27(39-37-25-15-19(31(45)49-3)7-13-23(25)33(47)51-5)29(43)35-21-9-11-22(12-10-21)36-30(44)28(18(2)42)40-38-26-16-20(32(46)50-4)8-14-24(26)34(48)52-6/h7-16,27-28H,1-6H3,(H,35,43)(H,36,44)/b39-37+,40-38+
- Structural formula:
Related substances
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