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CAS No.: | 15909-83-8 |
---|---|
Name: | 3-HYDROXYPROPANESULFONIC ACID |
Article Data: | 16 |
Molecular Structure: | |
Formula: | C3H8O4S |
Molecular Weight: | 140.16 |
Synonyms: | 1-Hydroxypropane-3-sulfonicacid;3-Hydroxy-1-propanesulfonic acid;3-Hydroxypropanesulfonic acid; |
EINECS: | 240-051-8 |
Density: | 1.489 g/cm3 |
Flash Point: | 100 °C |
Hazard Symbols: | T |
Risk Codes: | 45-21/22-35 |
Safety: | 53-26-36/37/39-45 |
PSA: | 82.98000 |
LogP: | 0.33740 |
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The 1-Propanesulfonic acid,3-hydroxy- is an organic compound with the formula C3H8O4S. The IUPAC name of this chemical is 3-Hydroxypropane-1-sulfonic acid. With the CAS registry number 15909-83-8, it is also named as 3-Hydroxy-1-propanesulfonic acid. The product's categories are Organic Building Blocks; Sulfonic/Sulfinic Acids; Sulfur Compounds. Besides, its molecular weight is 140.16.
Physical properties about 1-Propanesulfonic acid,3-hydroxy- are: (1)ACD/LogP: -2.30; (2)ACD/LogD (pH 5.5): -5.67; (3)ACD/LogD (pH 7.4): -5.8; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 60.98 Å2; (12)Index of Refraction: 1.503; (13)Molar Refractivity: 27.81 cm3; (14)Molar Volume: 94.1 cm3; (15)Polarizability: 11.02×10-24 cm3; (16)Surface Tension: 65.9 dyne/cm; (17)Density: 1.489 g/cm3.
Preparation: this chemical can be prepared by 3,3'-Disulfanediyl-bis-propan-1-ol. This reaction will need reagent NaIO4 / borate buffer (pH 8.0), and solvent H2O. The reaction temperature is 23 °C.
Uses of 1-Propanesulfonic acid,3-hydroxy-: it can be used to produce [1,2]Oxathiolane 2,2-dioxide at temperature of 145 - 160 °C. It will need reagent VT-6 titanium alloy. The yield is about 94.8%.
When you are using this chemical, please be cautious about it as the following:
It may cause cancer. And it causes severe burns. Besides, this chemical is harmful by inhalation and in contact with skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C3H8O4S/c4-2-1-3-8(5,6)7/h4H,1-3H2,(H,5,6,7)
(2)InChIKey: WQPMYSHJKXVTME-UHFFFAOYAX
(3)Std. InChI: InChI=1S/C3H8O4S/c4-2-1-3-8(5,6)7/h4H,1-3H2,(H,5,6,7)
(4)Std. InChIKey: WQPMYSHJKXVTME-UHFFFAOYSA-N