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| CAS No.: | 130561-87-4 |
|---|---|
| Name: | bromocyclopropane |
| Article Data: | 23 |
| Molecular Structure: | |
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| Formula: | C3H5Br |
| Molecular Weight: | 120.9758 |
| Synonyms: | Bromocyclopropane; |
| Density: | 1.789 g/cm3 |
| Boiling Point: | 69 °C at 760 mmHg |
| PSA: | 0.00000 |
| LogP: | 1.54370 |
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Specification
The CAS registry number of Cyclopropane, bromo-, radical ion(1+) is 130561-87-4. This chemical's molecular formula is C3H5Br and molecular weight is 120.9758. What's more, its systematic name is Bromocyclopropane.
Physical properties about Cyclopropane, bromo-, radical ion(1+) are: (1)ACD/LogP: 1.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.51; (4)ACD/LogD (pH 7.4): 1.51; (5)ACD/BCF (pH 5.5): 8.34; (6)ACD/BCF (pH 7.4): 8.34; (7)ACD/KOC (pH 5.5): 158.88; (8)ACD/KOC (pH 7.4): 158.88; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.552; (14)Molar Refractivity: 21.62 cm3; (15)Molar Volume: 67.6 cm3; (16)Polarizability: 8.57×10-24 cm3; (17)Surface Tension: 41.2 dyne/cm; (18)Density: 1.789 g/cm3; (19)Enthalpy of Vaporization: 29.78 kJ/mol; (20)Boiling Point: 69 °C at 760 mmHg; (21)Vapour Pressure: 148 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: BrC1CC1
(2) InChI: InChI=1/C3H5Br/c4-3-1-2-3/h3H,1-2H2
(3) InChIKey: LKXYJYDRLBPHRS-UHFFFAOYAT