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CAS No.: | 61714-24-7 |
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Name: | N-(5-AMINOPENTYL)-5-CHLORO-1-NAPHTHALENE-SULFONAMIDE HYDROCHLORIDE |
Molecular Structure: | |
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Formula: | 15H19ClN2O2S.ClH |
Molecular Weight: | 363.30 |
Synonyms: | 5-{[(5-Chloronaphthalen-1-yl)sulfonyl]amino}pentan-1-aminium chloride;N-(5-Aminopentyl)-5-chloronaphthalene-1-sulphonamide hydrochloride; |
Melting Point: | 213-215°C |
Boiling Point: | 509.9 °C at 760 mmHg |
Flash Point: | 262.2 °C |
PSA: | 80.57000 |
LogP: | 5.87450 |
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The CAS registry number of 1-Naphthalenesulfonamide, N-(5-aminopentyl)-5-chloro-,monohydrochloride is 61714-24-7. The systematic name is 5-{[(5-chloronaphthalen-1-yl)sulfonyl]amino}pentan-1-aminium chloride. In addition, the molecular formula is C15H19ClN2O2S.ClH and the molecular weight is 363.30. What's more, it should be stored in a cool and dry place.
Physical properties about this chemical are: (1)ACD/LogP: 2.97; (2)ACD/LogD (pH 5.5): -0.12; (3)ACD/LogD (pH 7.4): 0.18; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1.59; (8)#H bond acceptors: 4; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 7; (11)Polar Surface Area: 45.76 Å2; (12)Flash Point: 262.2 °C; (13)Enthalpy of Vaporization: 78.06 kJ/mol; (14)Boiling Point: 509.9 °C at 760 mmHg; (15)Vapour Pressure: 1.63E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].O=S(=O)(c1cccc2c1cccc2Cl)NCCCCC[NH3+]
(2)InChI: InChI=1/C15H19ClN2O2S.ClH/c16-14-8-4-7-13-12(14)6-5-9-15(13)21(19,20)18-11-3-1-2-10-17;/h4-9,18H,1-3,10-11,17H2;1H
(3)InChIKey: PIIRROLPTDOPIH-UHFFFAOYAK