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CAS No.: | 3460-24-0 |
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Name: | 1,4-DIBROMO-2-CHLOROBENZENE |
Molecular Structure: | |
Formula: | C6H3Br2Cl |
Molecular Weight: | 270.351 |
Synonyms: | 1,4-Dibromo-2-chlorobenzene;2-Chloro-1,4-dibromobenzene; |
Density: | 2.021 g/cm3 |
Melting Point: | 39-42 °C |
Boiling Point: | 258.5 °C at 760 mmHg |
Flash Point: | 119.6 °C |
Appearance: | white to light yellow crystal powder |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 37/39-26 |
PSA: | 0.00000 |
LogP: | 3.86500 |
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The Benzene, 1, 4-dibromo-2-chloro-, with the CAS registry number of 3460-24-0, is also known as 1, 4-Dibromo-2-chlorobenzene and 1-Chloro-2, 5-dibromobenzene. It belongs to the product categories of Aromatic Halides (substituted); Bromine Compounds; Chlorine Compounds. This chemical's molecular formula is C6H3Br2Cl and molecular weight is 270.35. What's more, its systematic name is called 1, 4-Dibromo-2-chloro-benzene.
Physical properties about Benzene, 1, 4-dibromo-2-chloro- are: (1)ACD/LogP: 4.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.24; (4)ACD/LogD (pH 7.4): 4.24; (5)#H bond acceptors: 0; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Index of Refraction: 1.612; (9)Molar Refractivity: 46.52 cm3; (10)Molar Volume: 133.7 cm3; (11)Polarizability: 18.44×10-24 cm3; (12)Surface Tension: 43.8 dyne/cm; (13)Density: 2.021 g/cm3; (14)Flash Point: 119.6 °C; (15)Enthalpy of Vaporization: 47.61 kJ/mol; (16)Boiling Point: 258.5 °C at 760 mmHg; (17)Vapour Pressure: 0.0221 mmHg at 25 °C; (18)Melting Point: 39-42 °C.
When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: Brc1ccc(Br)c(Cl)c1
(2) InChI: InChI=1/C6H3Br2Cl/c7-4-1-2-5(8)6(9)3-4/h1-3H
(3) InChIKey: LOWQAATYMJIWOG-UHFFFAOYAI