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| CAS No.: | 89282-37-1 |
|---|---|
| Name: | 5-BROMO-2-FUROIC ACID HYDRAZIDE |
| Molecular Structure: | |
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| Formula: | C5H5BrN2O2 |
| Molecular Weight: | 205.011 |
| Synonyms: | 2-Furoicacid, 5-bromo-, hydrazide (7CI);5-Bromofuran-2-carboxylic acid hydrazide; |
| Density: | 1.768g/cm3 |
| Melting Point: | 136-138°C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 68.26000 |
| LogP: | 1.73680 |
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- Total:23 Page 1 of 1 1
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Specification
The 2-Furancarboxylic acid,5-bromo-, hydrazide, with CAS registry number 89282-37-1, belongs to the following product category: Aromatic Hydrazides, Hydrazines, Hydrazones and Oximes. It has the systematic name of 5-bromofuran-2-carbohydrazide. And its IUPAC name is the same one. The chemical formula of this chemical is C5H5BrN2O2.
Physical properties of 2-Furancarboxylic acid,5-bromo-, hydrazide: (1)ACD/LogP: 0.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.59; (4)ACD/LogD (pH 7.4): 0.59; (5)ACD/BCF (pH 5.5): 1.65; (6)ACD/BCF (pH 7.4): 1.66; (7)ACD/KOC (pH 5.5): 49.87; (8)ACD/KOC (pH 7.4): 49.96; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 36.69 Å2; (13)Index of Refraction: 1.583; (14)Molar Refractivity: 38.76 cm3; (15)Molar Volume: 115.9 cm3; (16)Polarizability: 15.36×10-24cm3; (17)Surface Tension: 53.9 dyne/cm.
When you are using this chemical, please be cautious about it as the following:
The 2-Furancarboxylic acid,5-bromo-, hydrazide irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If 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: O=C(NN)c1ccc(Br)o1
(2)InChI: InChI=1/C5H5BrN2O2/c6-4-2-1-3(10-4)5(9)8-7/h1-2H,7H2,(H,8,9)
(3)InChIKey: AKANWSCBFOMJNS-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C5H5BrN2O2/c6-4-2-1-3(10-4)5(9)8-7/h1-2H,7H2,(H,8,9)
(5)Std. InChIKey: AKANWSCBFOMJNS-UHFFFAOYSA-N