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CAS No.: | 26125-61-1 |
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Name: | 1,4-Benzenedicarbonyl dichloride, polymer with 1,4-benzenediamine |
Molecular Structure: | |
Formula: | C14H12Cl2N2O2 |
Molecular Weight: | 311.16748 |
Synonyms: | para-Aramid fibrils;para-Phenylenediamine terephthalic acid chloride copolymer;1,4-Benzenedicarbonyl dichloride, polymer with 1,4-benzenediamine;1,4-Benzenedicaronyl dichloride, polymer with 1,4-benzenediamine; |
Boiling Point: | 266 °C at 760 mmHg |
Flash Point: | 143.1 °C |
PSA: | 86.18000 |
LogP: | 4.45800 |
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The CAS register number of Benzene-1,4-diamine; benzene-1,4-dicarbonyl chloride is 26125-61-1. It also can be called as 1,4-Benzenedicaronyl dichloride, polymer with 1,4-benzenediamine and the systematic name about this chemical is benzene-1,4-dicarbonyl dichloride - benzene-1,4-diamine (1:1). The molecular formula about this chemical is C14H12Cl2N2O2 and the molecular weight is 311.16748.
Physical properties about Benzene-1,4-diamine; benzene-1,4-dicarbonyl chloride are: (1)ACD/LogP: 2.63; (2)ACD/LogD (pH 5.5): 2.63; (3)ACD/LogD (pH 7.4): 2.63; (4)ACD/BCF (pH 5.5): 58.69; (5)ACD/BCF (pH 7.4): 58.69; (6)ACD/KOC (pH 5.5): 642.01; (7)ACD/KOC (pH 7.4): 642.01; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 34.14 Å2; (11)Flash Point: 143.1 °C; (12)Enthalpy of Vaporization: 50.4 kJ/mol; (13)Boiling Point: 266 °C at 760 mmHg; (14)Vapour Pressure: 0.00887 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: ClC(=O)c1ccc(C(Cl)=O)cc1.Nc1ccc(N)cc1
(2)InChI: InChI=1/C8H4Cl2O2.C6H8N2/c9-7(11)5-1-2-6(4-3-5)8(10)12;7-5-1-2-6(8)4-3-5/h1-4H;1-4H,7-8H2
(3)InChIKey: KIEIYPCTMJWBOD-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C8H4Cl2O2.C6H8N2/c9-7(11)5-1-2-6(4-3-5)8(10)12;7-5-1-2-6(8)4-3-5/h1-4H;1-4H,7-8H2
(5)Std. InChIKey: KIEIYPCTMJWBOD-UHFFFAOYSA-N