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CAS No.: | 15396-38-0 |
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Name: | 2,3,5-Tribromobenzoic acid |
Molecular Structure: | |
Formula: | C7H3Br3O2 |
Molecular Weight: | 358.812 |
Synonyms: | 2,3,5-Tribromobenzoic acid; |
Density: | 2.384 g/cm3 |
Melting Point: | 193-194℃ |
Boiling Point: | 391.533 °C at 760 mmHg |
Flash Point: | 190.593 °C |
PSA: | 37.30000 |
LogP: | 3.67230 |
methyl-1,2,5-tribromobenzene
2,3,5-tribromo-benzoic acid
Conditions | Yield |
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With nitric acid at 135 - 140℃; |
2,3,5-tribromo-benzoic acid
Conditions | Yield |
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With permanganate(VII) ion |
2-amino-3,5-dibromobenzoic acid
2,3,5-tribromo-benzoic acid
anthranilic acid
2,3,5-tribromo-benzoic acid
Conditions | Yield |
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Multi-step reaction with 2 steps 1: glacial acetic acid; concentrated aqueous potassium bromide; bromine 2: Diazotization.Verkochen mit Kupferbromuer View Scheme | |
Multi-step reaction with 2 steps 1: diluted hydrochloric acid; bromine View Scheme |
2,3-dibromo-5-nitro-toluene
2,3,5-tribromo-benzoic acid
Conditions | Yield |
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Multi-step reaction with 3 steps 1: tin; hydrochloric acid 3: diluted nitric acid / 135 - 140 °C View Scheme |
2,3,5-tribromo-benzoic acid
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 2: diluted nitric acid / 135 - 140 °C View Scheme |
2,3,5-tribromo-benzoic acid
3,5-dibromosalicylic acid
Conditions | Yield |
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With water; copper; potassium carbonate |
2,3,5-tribromo-benzoic acid
benzoic-2,3,5-d3 acid
Conditions | Yield |
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With deuteriated sodium hydroxide; copper aluminum at 40℃; for 0.5h; Yield given; |
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The 2,3,5-Tribromobenzoic acid, with the CAS registry number 15396-38-0, is also known as 2,3,5-Tribromo-benzoic acid. It belongs to the product categories of Acids & Esters; Bromine Compounds. This chemical's molecular formula is C7H3Br3O2 and molecular weight is 358.80952. What's more, its systematic name is called 2,3,5-Tribromobenzoic acid.
Physical properties about 2,3,5-Tribromobenzoic acid are: (1)ACD/LogP: 4.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2; (8)ACD/KOC (pH 7.4): 2; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 37.3 Å2; (13)Index of Refraction: 1.67; (14)Molar Refractivity: 56.253 cm3; (15)Molar Volume: 150.517 cm3; (16)Surface Tension: 61.139 dyne/cm; (17)Density: 2.384 g/cm3; (18)Flash Point: 190.593 °C; (19)Enthalpy of Vaporization: 67.622 kJ/mol; (20)Boiling Point: 391.533 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Brc1c(cc(Br)cc1Br)C(O)=O
(2) InChI: InChI=1/C7H3Br3O2/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2H,(H,11,12)
(3) InChIKey: VXRZWSOTDBLHDQ-UHFFFAOYAF