alpha-((3-(Dimethylamino)propoxy)methyl)benzo(b)thiophene-6-methanol

Base Information

• Chemical Name: alpha-((3-(Dimethylamino)propoxy)methyl)benzo(b)thiophene-6-methanol
• CAS No.: 131965-14-5
• Molecular Formula: C15H21 N O2 S
• Molecular Weight: 279.4
• DSSTox Substance ID: DTXSID00927480
• Mol file: 131965-14-5.mol

Synonyms:131965-14-5;alpha-((3-(Dimethylamino)propoxy)methyl)benzo(b)thiophene-6-methanol;1-(1-benzothiophen-6-yl)-2-[3-(dimethylamino)propoxy]ethanol;Benzo(b)thiophene-6-methanol, alpha-((3-(dimethylamino)propoxy)methyl)-;DTXSID00927480;MYEQGSQJPQAJRB-UHFFFAOYSA-N;LS-41236;1-(1-Benzothiophen-6-yl)-2-[3-(dimethylamino)propoxy]ethan-1-ol

Chemical Property of alpha-((3-(Dimethylamino)propoxy)methyl)benzo(b)thiophene-6-methanol

Chemical Property:

• Vapor Pressure: 7.59E-08mmHg at 25°C
• Boiling Point: 421.2°Cat760mmHg
• PKA: 13.52±0.20(Predicted)
• Flash Point: 208.5°C
• PSA: 60.94000
• Density: 1.162g/cm³
• LogP: 2.90300
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 279.12930009
• Heavy Atom Count: 19
• Complexity: 263

Purity/Quality:

ALPHA-((3-(DIMETHYLAMINO)PROPOXY)METHYL)BENZO(B)THIOPHENE-6-METHANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCCOCC(C1=CC2=C(C=C1)C=CS2)O

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