Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Pyridine-3-sulphonyl chloride hydrochloride |
EINECS | N/A |
CAS No. | 42899-76-3 | Density | N/A |
PSA | 55.41000 | LogP | 2.08990 |
Solubility | Reacts with water. | Melting Point |
120-126°C |
Formula | C5H4ClNO2S.ClH | Boiling Point | 314.4 °C at 760 mmHg |
Molecular Weight | 214.072 | Flash Point | 143.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 8-22-26-30-45-36/37/39 | Risk Codes |
C:; |
Molecular Structure | Hazard Symbols | C | |
Synonyms |
3-Pyridinesulfonylchloride, hydrochloride (9CI);3-Pyridylsulfonyl chloride hydrochloride; |
Article Data | 13 |
The 3-Pyridinesulfonylchloride, hydrochloride (1:1), with cas register number of 42899-76-3, belongs to categories of blocks; Pyridines. It also can be called 3-pyridinesulfonyl chloride; Pyridine-3-sulfonyl chloride ; Pyridine-3-sulfonyl chloride hydrochloride. Its systematic name is called pyridine-3-sulfonyl chloride hydrochloride (1:1). This chemical is corrosive. It should be stored below -20°C.
Physical properties about this chemical are: (1)ACD/LogP: 0.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 44; (8)ACD/KOC (pH 7.4): 44; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 55.41 Å2; (13)Flash Point: 143.9 °C; (14)Enthalpy of Vaporization: 56.66 kJ/mol; (15)Boiling Point: 314.4 °C at 760 mmHg; (16)Vapour Pressure: 0.000344 mmHg at 25°C; (17)Melting Point: 120-126°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=S(=O)(Cl)c1cccnc1;
(2)InChI: InChI=1/C5H4ClNO2S.ClH/c6-10(8,9)5-2-1-3-7-4-5;/h1-4H;1H;
(3)InChIKey: VIVPWOMJFLICOZ-UHFFFAOYAS