(S)-2-(3,4-Dimethoxyphenyl)-7-methoxychroman

Base Information

• Chemical Name: (S)-2-(3,4-Dimethoxyphenyl)-7-methoxychroman
• CAS No.: 116384-26-0
• Molecular Formula: C18H20O4
• Molecular Weight: 300
• Hs Code.: 2932999099
• DSSTox Substance ID: DTXSID701157803
• Mol file: 116384-26-0.mol

Synonyms:116384-26-0;3',4',7-Trimethoxyflavan;(S)-2-(3,4-Dimethoxyphenyl)-7-methoxychroman;(2S)-3',4',7-Trimethoxyflavan;(2S)-2-(3,4-dimethoxyphenyl)-7-methoxy-3,4-dihydro-2H-chromene;DTXSID701157803;HY-N1768;AKOS022184896;FS-10186;CS-0017623;2H-1-Benzopyran, 2-(3,4-dimethoxyphenyl)-3,4-dihydro-7-methoxy-, (S)-;2H-1-Benzopyran, 2-(3,4-dimethoxyphenyl)-3,4-dihydro-7-methoxy-, (S)- (9CI)

Chemical Property of (S)-2-(3,4-Dimethoxyphenyl)-7-methoxychroman

Chemical Property:

• PSA: 36.92000
• LogP: 3.77870
• Storage Temp.: 2-8°C
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 300.13615911
• Heavy Atom Count: 22
• Complexity: 348

Purity/Quality:

98%min ^*data from raw suppliers

3',4',7-Trimethoxyflavan 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=C(CCC(O2)C3=CC(=C(C=C3)OC)OC)C=C1
• Isomeric SMILES: COC1=CC2=C(CC[C@H](O2)C3=CC(=C(C=C3)OC)OC)C=C1