Basic information
- CAS
22084-94-2- Standard SMILES
COc1ccc2c(C)cc(=O)oc2c1O- InChIKey
HHSJFOILNWMNFO-UHFFFAOYSA-N- Molecular formula
- C11H10O4
- Average molar mass
- 206.19 g/mol
- Monoisotopic mass
- 206.0579088
Names & identifiers
- Preferred name
- 8-Hydroxy-7-methoxy-4-methyl-2H-1-benzopyran-2-one
- IUPAC
- 8-hydroxy-7-methoxy-4-methylchromen-2-one
- English name
- 7-Methoxy-8-hydroxy-4-MethylcouMarin
- Molecular formula
- C11H10O4
- Molecular weight
- 206.19
Names & synonyms
22084-94-28-Hydroxy-7-methoxy-4-methyl-2H-1-benzopyran-2-oneRefChem:3120738-Hydroxy-7-methoxy-4-methyl-2H-chromen-2-one7-Methoxy-4-methyl-coumarin-8-ol7-Methoxy-8-hydroxy-4-MethylcouMarin8-hydroxy-7-methoxy-4-methylchromen-2-oneCHEMBL4780696Coumarin-8-ol, 7-methoxy-4-methyl-orb1297692SCHEMBL15984891TJP2865
Show more names
7-methoxy-8-hydroxy-4-methylcoumarin, 10 mM in DMSO2H-1-Benzopyran-2-one, 8-hydroxy-7-methoxy-4-methyl-Inhibitor,inhibit,7 methoxy 8 hydroxy 4 methylcoumarin,7methoxy8hydroxy4methylcoumarin
HHSJFOILNWMNFO-UHFFFAOYSA-NDTXSID401227217BDBM50555094HY-N100154-Methyl-7-methoxy-8-hydroxycoumarinAKOS022186221EBC-617306?8-Hydroxy-7-methoxy-4-methyl-cumarin
Database identifiers
- CAS
22084-94-2- PubChem CID
- 596086
- DTXSID
DTXSID401227217- ChEMBL
CHEMBL4780696
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 297
Physicochemical properties
- storage temp.
- 4 °C, · 4°C, away from moisture and light
- solubility
- 100 mg/mL · DMSO : 100 mg/mL (484.99 mM; Need ultrasonic)
- form
- Solid
- color
- White to off-white
Chemistry & industry
Applications
Uses7-Methoxy-4-methyl-coumarin-8-ol (compound 31) is a compound isolated from sour orange (Citrus aurantium)[1].
Upstream & downstream products
Upstream raw materials
Suppliers36 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
成都普睿法药物研发有限公司82633860 18982077548 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
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成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
成都普菲德生物技术有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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