Geraldol

Base Information

• Chemical Name: Geraldol
• CAS No.: 21511-25-1
• Molecular Formula: C16H12O6
• Molecular Weight: 300.268
• Hs Code.: 2914509090
• European Community (EC) Number: 244-414-1
• UNII: 2KR35TI2XV
• DSSTox Substance ID: DTXSID30175851
• Nikkaji Number: J226.217G
• Wikidata: Q83046182
• Metabolomics Workbench ID: 24651
• ChEMBL ID: CHEMBL509256
• Mol file: 21511-25-1.mol

Synonyms:3,4',7-trihydroxy-3'-methoxyflavone;geraldol

Chemical Property of Geraldol

Chemical Property:

• Vapor Pressure: 2.28E-13mmHg at 25°C
• Melting Point: >300 °C
• Refractive Index: 1.709
• Boiling Point: 559.8 °C at 760 mmHg
• PKA: 6.82±0.40(Predicted)
• Flash Point: 213.5 °C
• PSA: 100.13000
• Density: 1.538 g/cm³
• LogP: 2.58540
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 300.06338810
• Heavy Atom Count: 22
• Complexity: 473

Purity/Quality:

99% ^*data from raw suppliers

3''-Methoxy-3,7,4''-trihydroxyflavone ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O)O
• Uses: 3'-Methoxy-3,7,4'-trihydroxyflavone (cas# 21511-25-1) is a useful research chemical. 3-O-Methylfisetin is a flavonoid with antimalarial activity.