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CAS No.: | 374-25-4 |
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Name: | 1-BROMO-2-CHLORO-1,1,2-TRIFLUORO-3-BUTENE |
Molecular Structure: | |
Formula: | C4H3BrClF3 |
Molecular Weight: | 223.42 |
Synonyms: | 4-Bromo-3-chloro-3,4,4-trifluoro-1-butene;NSC 117347; |
Density: | 1.709 g/cm3 |
Boiling Point: | 111.3 °C at 760 mmHg |
Flash Point: | 21.1 °C |
Hazard Symbols: | F |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 0.00000 |
LogP: | 3.06470 |
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The 1-Butene,4-bromo-3-chloro-3,4,4-trifluoro- is an organic compound with the formula C4H3BrClF3. The IUPAC name of this chemical is 4-bromo-3-chloro-3,4,4-trifluorobut-1-ene. With the CAS registry number 374-25-4, it is also named as Bromochlorotrifluorobutene.
Physical properties about 1-Butene,4-bromo-3-chloro-3,4,4-trifluoro- are: (1)ACD/LogP: 3.26; (2)ACD/LogD (pH 5.5): 3.26; (3)ACD/LogD (pH 7.4): 3.26; (4)ACD/BCF (pH 5.5): 175.58; (5)ACD/BCF (pH 7.4): 175.58; (6)ACD/KOC (pH 5.5): 1406.73; (7)ACD/KOC (pH 7.4): 1406.73; (8)#Freely Rotating Bonds: 2; (9)Index of Refraction: 1.423; (10)Molar Refractivity: 33.3 cm3; (11)Molar Volume: 130.6 cm3; (12)Polarizability: 13.2×10-24cm3; (13)Surface Tension: 24.1 dyne/cm; (14)Density: 1.709 g/cm3; (15)Flash Point: 21.1 °C; (16)Enthalpy of Vaporization: 33.54 kJ/mol; (17)Boiling Point: 111.3 °C at 760 mmHg; (18)Vapour Pressure: 26.9 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are 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: ClC(F)(\C=C)C(Br)(F)F
(2)InChI: InChI=1/C4H3BrClF3/c1-2-3(6,7)4(5,8)9/h2H,1H2
(3)InChIKey: VULPFOSLGWWARI-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C4H3BrClF3/c1-2-3(6,7)4(5,8)9/h2H,1H2
(5)Std. InChIKey: VULPFOSLGWWARI-UHFFFAOYSA-N