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Name |
Morpholine,4-[(3-bromophenyl)sulfonyl]- |
EINECS | N/A |
CAS No. | 871269-13-5 | Density | 1.594g/cm3 |
PSA | 54.99000 | LogP | 2.48870 |
Solubility | N/A | Melting Point |
132-136 |
Formula | C10H12BrNO3S | Boiling Point | 427.2 °C at 760 mmHg |
Molecular Weight | 306.18 | Flash Point | 212.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
4-[(3-Bromophenyl)sulfonyl]morpholine; |
Article Data | 3 |
The Morpholine,4-[(3-bromophenyl)sulfonyl]-, with CAS registry number 871269-13-5, belongs to the following product categories: (1)Blocks; (2)Bromides; (3)Heterocycles; (4)Sulfonamides. It has the systematic name of 4-[(3-bromophenyl)sulfonyl]morpholine. And the chemical formula of this chemical is C10H12BrNO3S.
Physical properties of Morpholine,4-[(3-bromophenyl)sulfonyl]-: (1)ACD/LogP: 2.21; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 54.99 Å2; (7)Index of Refraction: 1.596; (8)Molar Refractivity: 65.39 cm3; (9)Molar Volume: 192 cm3; (10)Polarizability: 25.92×10-24cm3; (11)Surface Tension: 50.4 dyne/cm; (12)Density: 1.594 g/cm3; (13)Flash Point: 212.2 °C; (14)Enthalpy of Vaporization: 68.21 kJ/mol; (15)Boiling Point: 427.2 °C at 760 mmHg; (16)Vapour Pressure: 1.67E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(N1CCOCC1)c2cccc(Br)c2
(2)InChI: InChI=1/C10H12BrNO3S/c11-9-2-1-3-10(8-9)16(13,14)12-4-6-15-7-5-12/h1-3,8H,4-7H2
(3)InChIKey: BMAMBBTZMVECJZ-UHFFFAOYAT