Sodium 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetate, also known as caffeine sodium acetate, is a chemical compound derived from the purine alkaloid caffeine. It is a white crystalline powder with a molecular formula of C11H14N4NaO4 and a molecular weight of 290.25 g/mol. sodium 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetate is an ester of caffeine and acetic acid, where the hydroxyl group of caffeine is replaced by an acetate group. Caffeine sodium acetate is commonly used as a stimulant in various applications, such as beverages, pharmaceuticals, and dietary supplements, due to its ability to temporarily ward off drowsiness and restore alertness. It is also known for its potential benefits in enhancing physical performance and cognitive function.
837-27-4
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Basic information
- Product Name: sodium 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetate
- Synonyms: sodium 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetate;1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetic acid sodium salt
- CAS NO:837-27-4
- Molecular Formula: C9H9N4NaO4
- Molecular Weight: 260.18193
- EINECS: 212-652-5
- Product Categories: N/A
- Mol File: 837-27-4.mol
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Chemical Properties
- Melting Point: >300°
- Boiling Point: 555.7°C at 760 mmHg
- Flash Point: 289.9°C
- Appearance: /
- Density: N/A
- Vapor Pressure: 3.48E-13mmHg at 25°C
- Refractive Index: N/A
- Storage Temp.: N/A
- Solubility: N/A
- CAS DataBase Reference: sodium 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetate(CAS DataBase Reference)
- NIST Chemistry Reference: sodium 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetate(837-27-4)
- EPA Substance Registry System: sodium 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetate(837-27-4)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 837-27-4(Hazardous Substances Data)
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Check Digit Verification of cas no
The CAS Registry Mumber 837-27-4 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 8,3 and 7 respectively; the second part has 2 digits, 2 and 7 respectively.Calculate Digit Verification of CAS Registry Number 837-27:
(5*8)+(4*3)+(3*7)+(2*2)+(1*7)=84
84 % 10 = 4
So 837-27-4 is a valid CAS Registry Number.
InChI:InChI=1/C9H10N4O4.Na/c1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15;/h4H,3H2,1-2H3,(H,14,15);/q;+1/p-1
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sodium 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetate
