121961-20-4 Purity
96%
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Specification
The molecular formula of 4-Mercapto-1-butanol is C4H10OS.
The molecular weight of 4-Mercapto-1-butanol is 106.19 g/mol.
The IUPAC name of 4-Mercapto-1-butanol is 4-sulfanylbutan-1-ol.
The InChI of 4-Mercapto-1-butanol is InChI=1S/C4H10OS/c5-3-1-2-4-6/h5-6H,1-4H2.
The InChIKey of 4-Mercapto-1-butanol is NEJMTSWXTZREOC-UHFFFAOYSA-N.
The canonical SMILES of 4-Mercapto-1-butanol is C(CCS)CO.
The CAS number of 4-Mercapto-1-butanol is 14970-83-3.
The European Community (EC) number of 4-Mercapto-1-butanol is 628-399-2.
The XLogP3 value of 4-Mercapto-1-butanol is 0.1.
Yes, 4-Mercapto-1-butanol is a canonicalized compound.