1-Propanol, 3-[[2-[(1H-benzimidazol-2-ylsulfinyl)methyl]-3-methyl-4-pyridinyl]oxy]-

Base Information

• Chemical Name: 1-Propanol, 3-[[2-[(1H-benzimidazol-2-ylsulfinyl)methyl]-3-methyl-4-pyridinyl]oxy]-
• CAS No.: 117976-94-0
• Molecular Formula: C17H19 N3 O3 S
• Molecular Weight: 345.42
• UNII: I58UIQ1OYK
• DSSTox Substance ID: DTXSID90432674
• Nikkaji Number: J621.855E
• Wikidata: Q27280462
• Mol file: 117976-94-0.mol

Synonyms:117976-94-0;Desmethyl rabeprazole;1-Propanol, 3-[[2-[(1H-benzimidazol-2-ylsulfinyl)methyl]-3-methyl-4-pyridinyl]oxy]-;UNII-I58UIQ1OYK;I58UIQ1OYK;3-[2-(1H-benzimidazol-2-ylsulfinylmethyl)-3-methylpyridin-4-yl]oxypropan-1-ol;1-Propanol, 3-((2-((1H-benzimidazol-2-ylsulfinyl)methyl)-3-methyl-4-pyridinyl)oxy)-;SCHEMBL6582664;DTXSID90432674;OBQCUJTXRBUDMO-UHFFFAOYSA-N;AKOS015842448;CS-0166559;FT-0728892;Q27280462;2-[{4-(3-hydroxypropoxy)-3-methylpyridine-2-yl}methylsulfinyl]-1H-benzimidazole;3-[[2-[[(1H-Benzimidazol-2-yl)sulfinyl]methyl]-3-methylpyridin-4-yl]oxy]-1-propanol;3-((2-(((1H-benzo[d]imidazol-2-yl)sulfinyl)methyl)-3-methylpyridin-4-yl)oxy)propan-1-ol? (Rabeprazole Impurity

Chemical Property of 1-Propanol, 3-[[2-[(1H-benzimidazol-2-ylsulfinyl)methyl]-3-methyl-4-pyridinyl]oxy]-

Chemical Property:

• Boiling Point: 635.0±65.0 °C(Predicted)
• PKA: 9.57±0.10(Predicted)
• PSA: 107.31000
• Density: 1.41±0.1 g/cm3(Predicted)
• LogP: 3.20100
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 345.11471265
• Heavy Atom Count: 24
• Complexity: 426

Purity/Quality:

98% ^*data from raw suppliers

1-PROPANOL, 3-[[2-[(1H-BENZIMIDAZOL-2-YLSULFINYL)METHYL]-3-METHYL-4-PYRIDINYL]OXY]- 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CN=C1CS(=O)C2=NC3=CC=CC=C3N2)OCCCO