4,5,7-Trihydroxy-4'-methoxy-3-phenylcoumarin, also known as scoparone, is a naturally occurring chemical compound belonging to the coumarin family. It is characterized by its unique structure, featuring three hydroxyl groups at the 4, 5, and 7 positions, a methoxy group at the 4' position, and a phenyl group at the 3 position. Scopoletin, as it is commonly referred to, is found in various plants and has been reported to possess a range of biological activities, including antioxidant, anti-inflammatory, and anticoagulant properties. Its chemical formula is C14H12O6, and it has a molecular weight of 276.24 g/mol. Scopoletin is often used in research and pharmaceutical applications due to its potential therapeutic benefits and is also employed as a chemical marker for the quality control of herbal medicines.

4376-81-2

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Basic information
1. Product Name: 4,5,7-TRIHYDROXY-4'-METHOXY-3-PHENYLCOUMARIN
2. Synonyms: 4,5,7-TRIHYDROXY-4'-METHOXY-3-PHENYLCOUMARIN;3-(4-Methoxyphenyl)-4,5,7-trihydroxycoumarin;4,5,7-trihydroxy-3-(4-methoxyphenyl)chromen-2-one
3. CAS NO:4376-81-2
4. Molecular Formula: C16H12O6
5. Molecular Weight: 300.26288
6. EINECS: N/A
7. Product Categories: N/A
8. Mol File: 4376-81-2.mol
Chemical Properties
1. Melting Point: N/A
2. Boiling Point: 610.455°C at 760 mmHg
3. Flash Point: 233.641°C
4. Appearance: /
5. Density: 1.539g/cm³
6. Vapor Pressure: 0mmHg at 25°C
7. Refractive Index: 1.71
8. Storage Temp.: N/A
9. Solubility: N/A
10. CAS DataBase Reference: 4,5,7-TRIHYDROXY-4'-METHOXY-3-PHENYLCOUMARIN(CAS DataBase Reference)
11. NIST Chemistry Reference: 4,5,7-TRIHYDROXY-4'-METHOXY-3-PHENYLCOUMARIN(4376-81-2)
12. EPA Substance Registry System: 4,5,7-TRIHYDROXY-4'-METHOXY-3-PHENYLCOUMARIN(4376-81-2)
Safety Data
1. Hazard Codes: N/A
2. Statements: N/A
3. Safety Statements: N/A
4. WGK Germany:
5. RTECS:
6. HazardClass: N/A
7. PackingGroup: N/A
8. Hazardous Substances Data: 4376-81-2(Hazardous Substances Data)

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Check Digit Verification of cas no

The CAS Registry Mumber 4376-81-2 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,3,7 and 6 respectively; the second part has 2 digits, 8 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 4376-81:
(6*4)+(5*3)+(4*7)+(3*6)+(2*8)+(1*1)=102
102 % 10 = 2
So 4376-81-2 is a valid CAS Registry Number.

InChI:InChI=1/C16H12O6/c1-21-10-4-2-8(3-5-10)13-15(19)14-11(18)6-9(17)7-12(14)22-16(13)20/h2-7,17-19H,1H3

4376-81-2Upstream product

4376-81-2Downstream Products

113454-52-7 4,5,7-triacetoxy-3-(4-methoxy-phenyl)-coumarin

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