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| CAS No.: | 19146-62-4 |
|---|---|
| Name: | N,N'-decane-1,10-diylbis(2-methylquinolin-4-ammonium) diacetate |
| Molecular Structure: | |
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| Formula: | C30H38N4•2C2H4O2 |
| Molecular Weight: | 574.84 |
| Synonyms: | N,N'-Decane-1,10-diylbis(2-methylquinolin-4-ammonium) diacetate;Quinaldine, 4,4'-(decamethylenediimino)di-, diacetate; |
| Safety: | Moderately toxic by ingestion and subcutaneous routes. When heated to decomposition it emits toxic vapors of NOx. |
| PSA: | 124.44000 |
| LogP: | 8.37240 |
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Chemistry
Molecule structure of Salvicyklin (CAS NO.19146-62-4) :
IUPAC Name: acetic acid; N,N'-bis(2-methylquinolin-4-yl)decane-1,10-diamine
Molecular Weight: 574.75344 g/mol
Molecular Formula: C34H46N4O4
Boiling Point: 873.4 °C at 760 mmHg
Flash Point: 482 °C
Enthalpy of Vaporization: 132.99 kJ/mol
Vapour Pressure: 1.3E-32 mmHg at 25 °C
H-Bond Donor: 4
H-Bond Acceptor: 8
Rotatable Bond Count: 13
Tautomer Count: 15
Exact Mass: 574.351906
MonoIsotopic Mass: 574.351906
Topological Polar Surface Area: 124
Heavy Atom Count: 42
Complexity: 537
Canonical SMILES: CC1=NC2=CC=CC=C2C(=C1)NCCCCCCCCCCNC3=CC(=NC4=CC=CC=C43)C.CC(=O)O.CC(=O)O
InChI: InChI=1S/C30H38N4.2C2H4O2/c1-23-21-29(25-15-9-11-17-27(25)33-23)31-19-13-7-5-3-4-6-8-14-20-32-30-22-24(2)34-28-18-12-10-16-26(28)30;2*1-2(3)4/h9-12,15-18,21-22H,3-8,13-14,19-20H2,1-2H3,(H,31,33)(H,32,34);2*1H3,(H,3,4)
InChIKey: KJLDLEIBEQIBFL-UHFFFAOYSA-N
EINECS of Salvicyklin (CAS NO.19146-62-4) : 242-837-6
Toxicity Data With Reference
| 1. | orl-mus LD50:2125 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 19 (1969),1764. | ||
| 2. | scu-mus LD50:535 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 19 (1969),1764. |
Safety Profile
Moderately toxic by ingestion and subcutaneous routes. When heated to decomposition it emits toxic vapors of NOx.
Specification
Salvicyklin (CAS NO.19146-62-4) is also called Quindecamine acetate anhydrous ; UCL 1407 ; 1,10-Decanediamine, N,N'-bis(2-methyl-4-quinolinyl)-, diacetate ; 4-Quinolinamine, N,N'-1,10-decanediylbis(2-methyl-, diacetate ; N(sup 4),N(sup 4')-Decamethylene-bis-(4-aminoquinaldinium)-N,N-dihydroacetate ; N(sup 4),N(sup 4)-Dekamethylen-bis-(4-aminochinaldinium)-N,N-dihydroacetat ; N(sup 4),N(sup 4)-Dekamethylen-bis-(4-aminochinaldinium)-N,N-dihydroacetat [German] ; N,N'-Bis(2-methyl-4-quinolinyl)-1,10-decanediamine diacetate ; UCL-1407 .