Basic information
- CAS
26964-24-9- Standard SMILES
COc1ccc2oc(-c3ccccc3)cc(=O)c2c1- InChIKey
XZQLSABETMKIGG-UHFFFAOYSA-N- Molecular formula
- C16H12O3
- Average molar mass
- 252.26 g/mol
- Monoisotopic mass
- 252.07864424
Overview
6-Methoxyflavone is an ether and a member of flavonoids.
Names & identifiers
- Preferred name
- 6-Methoxyflavone
- IUPAC
- 6-methoxy-2-phenylchromen-4-one
- English name
- 6-METHOXYFLAVONE
- Molecular formula
- C16H12O3
- Molecular weight
- 252.26
Names & synonyms
6-Methoxyflavone26964-24-96-methoxy-2-phenylchromen-4-one4H-1-Benzopyran-4-one, 6-methoxy-2-phenyl-QAX7R06N2QDTXSID50181459RefChem:104948DTXCID10103950248-144-56-Methoxy-2-phenyl-4H-chromen-4-oneMFCD00017322Flavone, 6-methoxy-
Show more names
6-methoxyone6-methoxy-flavonMETHOXYFLAVONE, 6-6-Methoxyflavone>6-Methoxyflavone,98%6-methoxy-2-phenyl-chromone6-Methoxyflavone, 10 mM in DMSO
6-Methoxy-2-phenyl-4H-1-benzopyran-4-one6-Methoxy-2-phenyl-chromen-4-oneSCHEMBL312059MLS002473406CHEMBL137586CHEBI:193017LMPK12110100CCG-250451
Database identifiers
- CAS
26964-24-9- PubChem CID
- 147157
- DTXSID
DTXSID50181459- ChEMBL
CHEMBL137586- ChEBI
CHEBI:193017
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 368
Experimental & physicochemical properties
LipidsPolyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]
LogP3.22
Physicochemical properties
- Melting point
- 163 · 163-165 °C(lit.)
- Boiling point
- 421.2 · 421.2±45.0 °C(Predicted)
- Density
- 1.24 · 1.240±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- form
- powder to crystal
- color
- White to Almost white
- InChI
- 1S/C16H12O3/c1-18-12-7-8-15-13(9-12)14(17)10-16(19-15)11-5-3-2-4-6-11/h2-10H,1H3
- InChIKey
- XZQLSABETMKIGG-UHFFFAOYSA-N
- SMILES
- COc1ccc2OC(=CC(=O)c2c1)c3ccccc3
- LogP
- 3.47 · 3.470 (est)
- CAS DataBase Reference
- 26964 · 26964-24-9(CAS DataBase Reference)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 2
- rtecs
- DJ3100438
- hs_code
- 2914.50.3000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
Uses6-Methoxyflavone may be employed in the following studies:As internal standard for the analysis of polyphenolic content of in-vitro-cultured chestnut shoots.Synthesis of biflavonoids, rac- and meso-6,6-dimethoxy-2,2-biflavanones.As internal standard for the separation of phenolic compounds in the apricot tissue by HPLC.
General Description6-Methoxyflavone is one of the methoxyflavone isolated form Pimelea decora. Synthesis of 6-methoxyflavone from p-dihydroxybenzene has been reported.
Suppliers84 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海达立康医药科技有限公司18658316824 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
南京林叶化学试剂有限公司13376084917 13376082704 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.
Related reactions
2 records
Compound notes
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