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688798-57-4

Basic Information
CAS No.: 688798-57-4
Name: 4-[(2-Bromophenyl)sulphonyl]morpholine
Article Data: 4
Molecular Structure:
Molecular Structure of 688798-57-4 (4-[(2-Bromophenyl)sulphonyl]morpholine)
Formula: C10H12BrNO3S
Molecular Weight: 306.18
Synonyms: 4-[(2-Bromophenyl)sulfonyl]morpholine;
Density: 1.595 g/cm3
Boiling Point: 426.224 °C at 760 mmHg
Flash Point: 211.573 °C
Hazard Symbols: Xi
PSA: 54.99000
LogP: 2.48870
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Specification

The CAS registry number of 4-(2-Bromophenylsulfonyl)morpholine is 688798-57-4. This chemical's molecular formula is C10H12BrNO3S and molecular weight is 306.1762. What's more, its systematic name is called 4-[(2-Bromophenyl)sulfonyl]morpholine. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about 4-(2-Bromophenylsulfonyl)morpholine are: (1)ACD/LogP: 2.36; (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: 1.597; (8)Molar Refractivity: 65.394 cm3; (9)Molar Volume: 192.007 cm3; (10)Surface Tension: 50.482 dyne/cm; (11)Density: 1.595 g/cm3; (12)Flash Point: 211.573 °C; (13)Enthalpy of Vaporization: 68.1 kJ/mol; (14)Boiling Point: 426.224 °C at 760 mmHg; (15)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=S(=O)(N1CCOCC1)c2ccccc2Br
(2) InChI: InChI=1/C10H12BrNO3S/c11-9-3-1-2-4-10(9)16(13,14)12-5-7-15-8-6-12/h1-4H,5-8H2
(3) InChIKey: ZAPNWTPTHAUFJG-UHFFFAOYAI