1-(3-Chloropropyl)-3,7-diMethyl-1H-purine-2,6(3H,7H)-dione - Names and Identifiers
Name | Chloropropyltheobromine
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Synonyms | Chloropropyltheobromine 1-(3-CHLOROPROPYL)THEOBROMINE 1-(3-Chloropropyl)theobromine 1-(3-CHLOROPROPYL)-3,7-DIMETHYLXANTHINE 1-(3-Chloropropyl)-3,7-diMethyl-1H-purine-2,6(3H,7H)-dione 1-(3-Chloro-propyl)-3,7-diMethyl-3,7-dihydro-purine-2,6-dione 1-(3-CHLOROPROPYL)-3,7-DIHYDRO-3,7-DIMETHYL-1H-PURINE-2,6-DIONE 1-(3-chloropropyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione 1H-Purine-2,6-dione,1-(3-chloropropyl)-3,7-dihydro-3,7-diMethyl- 1-(3-Chloropropyl)-3,7-dihydro-3,7-dimethyl-1H-purine-2,6-dione
1-(3-Chloropropyl)-3,7-dimethylxanthine
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CAS | 74409-52-2
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InChI | InChI=1/C10H13ClN4O2/c1-13-6-12-8-7(13)9(16)15(5-3-4-11)10(17)14(8)2/h6H,3-5H2,1-2H3 |
1-(3-Chloropropyl)-3,7-diMethyl-1H-purine-2,6(3H,7H)-dione - Physico-chemical Properties
Molecular Formula | C10H13ClN4O2
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Molar Mass | 256.69 |
Density | 1.45 |
Melting Point | 145°C |
Boling Point | 478.2±51.0 °C(Predicted) |
Flash Point | 242.983°C |
Solubility | DMSO (Slightly), Methanol (Slightly, Heated) |
Vapor Presure | 0mmHg at 25°C |
Appearance | Solid |
Color | White |
pKa | 0.47±0.70(Predicted) |
Storage Condition | under inert gas (nitrogen or Argon) at 2-8°C |
Stability | Moisture Sensitive |
Refractive Index | 1.653 |
1-(3-Chloropropyl)-3,7-diMethyl-1H-purine-2,6(3H,7H)-dione - Risk and Safety
Safety Description | S22 - Do not breathe dust.
S24/25 - Avoid contact with skin and eyes.
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1-(3-Chloropropyl)-3,7-diMethyl-1H-purine-2,6(3H,7H)-dione - Introduction
Chloropropyltheobromine, also known as Chloropropyltheobromine, is an organic compound. It has a molecular formula of C11H14ClN4O2 and a molecular weight of 270.7g/mol.
Nature:
-Appearance: colorless or yellowish crystal
-Melting point: 140-143 degrees Celsius
-Solubility: Soluble in chloroform, dichloromethane and other organic solvents
Use:
- Chloropropyltheobromine is a vasodilator commonly used in the treatment of cardiovascular disease.
-It can also be used as a stimulant and antispasmodic.
Preparation Method:
Chloropropyltheobromine can be synthesized by the following steps:
1. the reaction of theophylline and 3-chloropropionic acid to generate 1-(3-chloropropyl) theophylline.
2.1-(3-Chloropropyl) theophylline is reacted with sodium hydroxide to generate Chloropropyltheobromine.
Safety Information:
Chloropropyltheobromine are generally less toxic under proper use and storage conditions. However, any chemical should be handled with caution. During use, follow appropriate laboratory safety procedures and pay attention to personal protective measures, such as wearing gloves, goggles and laboratory eye protection. For further safety information and operating instructions, please refer to the safety data sheet provided by the supplier.
Last Update:2024-04-10 22:29:15