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| CAS No.: | 197846-82-5 |
|---|---|
| Name: | 4-(3-BROMOPHENYL)MORPHOLINE |
| Article Data: | 11 |
| Molecular Structure: | |
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| Formula: | C10H12BrNO |
| Molecular Weight: | 242.115 |
| Synonyms: | 4-(3-Bromophenyl)morpholine; |
| Density: | 1.433 g/cm3 |
| Boiling Point: | 341.06 °C at 760 mmHg |
| Flash Point: | 160.067 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | Xi:Irritant; ">  Xi:Irritant; |
| PSA: | 12.47000 |
| LogP: | 2.35070 |
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- Total:35 Page 1 of 1 1
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Specification
The CAS register number of Morpholine,4-(3-bromophenyl)- is 197846-82-5. It also can be called as 1-Bromo-3-(morpholin-4-yl)benzene and the IUPAC name about this chemical is 4-(3-bromophenyl)morpholine. The molecular formula about this chemical is C10H12BrNO and the molecular weight is 242.11. It belongs to the following product categories which include Pharmacetical; Aryl; Organohalides; Halides; Phenyls & Phenyl-Het and so on.
Physical properties about Morpholine,4-(3-bromophenyl)- are: (1)ACD/LogP: 2.49; (2)#H bond acceptors: 2; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 12.47Å2; (5)Index of Refraction: 1.574; (6)Molar Refractivity: 55.75 cm3; (7)Molar Volume: 168.9 cm3; (8)Polarizability: 22.1x10-24cm3; (9)Surface Tension: 42.8 dyne/cm; (10)Flash Point: 160.1 °C; (11)Enthalpy of Vaporization: 58.47 kJ/mol; (12)Boiling Point: 341.1 °C at 760 mmHg; (13)Vapour Pressure: 8.25E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc2cc(N1CCOCC1)ccc2
(2)InChI: InChI=1/C10H12BrNO/c11-9-2-1-3-10(8-9)12-4-6-13-7-5-12/h1-3,8H,4-7H2
(3)InChIKey: RQMIVKDXRGZOBQ-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C10H12BrNO/c11-9-2-1-3-10(8-9)12-4-6-13-7-5-12/h1-3,8H,4-7H2
(5)Std. InChIKey: RQMIVKDXRGZOBQ-UHFFFAOYSA-N