Basic information
- CAS
35212-22-7- Standard SMILES
CC(C)Oc1ccc2c(=O)cc(-c3ccccc3)oc2c1- InChIKey
YVLFFUSZFGCFFW-UHFFFAOYSA-N- Molecular formula
- C18H16O3
- Average molar mass
- 280.3 g/mol
- Monoisotopic mass
- 280.10994437
Names & identifiers
- Preferred name
- 2-Phenyl-7-(propan-2-yloxy)-4h-chromen-4-one
- IUPAC
- 2-phenyl-7-propan-2-yloxychromen-4-one
- English name
- Ipriflavone
- Molecular formula
- C18H16O3
- Molecular weight
- 280.32
Names & synonyms
2-phenyl-7-(propan-2-yloxy)-4h-chromen-4-oneipraflavone2-phenyl-7-propan-2-yloxychromen-4-oneSpectrum_000012Spectrum3_001726Spectrum4_000129Spectrum5_000896BSPBio_003372KBioGR_000518KBioSS_000352DivK1c_000133SPECTRUM1400010
Show more names
YAMBOLAPIpriavoneIpriflavon7-ISOPROPOXYISOFLAVONEIpriflavone (Osteofix)7-(1-methylethoxy)-3-phenyl-4h-1-benzopyron-4-onetc80ostenfl113osteofix
CHEMBL1372514SCHEMBL27493025SCHEMBL30540840HMS500G15KBio1_000133KBio2_000352KBio2_002920KBio2_005488
Database identifiers
- CAS
35212-22-7- PubChem CID
- 3745
- ChEMBL
CHEMBL1372514
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 407
Physicochemical properties
- Melting point
- 116 · 116-120 °C(lit.)
- Boiling point
- 363.04 °C · 363.04°C (rough estimate)
- Density
- 1.217 · 1.2170 (rough estimate)
- refractive index
- 1.47 · 1.4700 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- 20 · DMF:20.0(Max Conc. mg/mL);71.35(Max Conc. mM)DMF:PBS (pH 7.2) (1:4):0.2(Max Conc. mg/mL);0.71(Max Conc. mM)DMSO:33.11(Max Conc. mg/mL);118.11(Max Conc. mM)Ethanol:1.5(Max Conc. mg/mL);5.35(Max Conc. mM)
- form
- powder to crystal
- color
- White to Almost white
- Merck
- 14 · 14,5074
- InChI
- InChI=1S/C18H16O3/c1-12(2)21-14-8-9-15-17(10-14)20-11-16(18(15)19)13-6-4-3-5-7-13/h3-12H,1-2H3
- InChIKey
- SFBODOKJTYAUCM-UHFFFAOYSA-N
- SMILES
- C1OC2=CC(OC(C)C)=CC=C2C(=O)C=1C1=CC=CC=C1
- LogP
- 4.245 · 4.245 (est)
- 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.
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 2
- rtecs
- DJ3100500
- hs_code
- 29329990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 24/25-36/37/39-27-26
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
DescriptionIpriflavone, a derivative of isoflavone, is a calcium metabolism regulator useful in the treatment of primary and secondary osteoporosis, as well as disorders of osteogenesis. It appears to be without significant side-effects.
Uses7-Isopropoxy-3-phenyl-4H-1-benzopyran-4-one (Ipriflavone) has been used as a model drug in a study to functionalize the mesoporous bioactive glasses (MBG). Study suggested that since ipriflavone is a hydrophobic anti-osteoporotic drug, it easily attaches to the surface of MBG and results in long-term drug delivery.
Usesanabolic
General Description7-Isopropoxy-3-phenyl-4H-1-benzopyran-4-one (Ipriflavone), a synthetic flavonoid, is reported to stimulate the activity of osteoblasts. It is reported to promote the deposition of calcium and the formation of mineralized nodules by newborn rat calvarial osteoblast-like (ROB) cells as well as the activity of alkaline phosphatase. Ipriflavone, an isoflavone derivative, is a new drug used to decrease bone loss in osteoporosis.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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