Substance
- Substance Name: thiamine hydrochloride
- Formula: C12H18Cl2N4OS
- Molecular Weight: 337.3 g/mol
- Identifiers:
- casrn: 67-03-8
- pubchemId: 6202
- iupacname: 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride
- inchi: InChI=1S/C12H17N4OS.2ClH/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;;/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);2*1H/q+1;;/p-1
- inchikey: DPJRMOMPQZCRJU-UHFFFAOYSA-M
- csmiles: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]
- ismiles: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]
- wikidataId: Q27121486
- chemspiderId: 5967
- dsstoxcmpId: DTXCID8020622
- chemblId: CHEMBL1200941
- ecnumber: 200-641-8
thiamine hydrochloride
Systems and Datasets
- thiamine hydrochloride + acetone + water (Datasets: 1)
- Dataset 3 in paper 10.1021/acs.jced.6b00613 (Dataseries: 8, Datapoints: 56, Quantity: Mole fraction)
- thiamine hydrochloride + water (Datasets: 16)
- Dataset 4 in paper 10.1021/acs.jced.6b00613 (Dataseries: 1, Datapoints: 8, Quantity: Mole fraction)
- Dataset 13 in paper 10.1021/acs.jced.7b00937 (Dataseries: 1, Datapoints: 16, Quantity: Dynamic viscosity)
- Dataset 9 in paper 10.1016/j.tca.2012.10.017 (Dataseries: 4, Datapoints: 24, Quantity: Dynamic viscosity)
- Dataset 10 in paper 10.1016/j.tca.2012.10.017 (Dataseries: 4, Datapoints: 20, Quantity: Speed of sound)
- Dataset 11 in paper 10.1016/j.tca.2012.10.017 (Dataseries: 4, Datapoints: 20, Quantity: Mass density)
- Dataset 1 in paper 10.1016/j.jct.2012.10.027 (Dataseries: 3, Datapoints: 40, Quantity: Mass density)
- Dataset 2 in paper 10.1016/j.jct.2012.10.027 (Dataseries: 3, Datapoints: 40, Quantity: Speed of sound)
- Dataset 3 in paper 10.1016/j.jct.2012.10.027 (Dataseries: 3, Datapoints: 40, Quantity: Dynamic viscosity)
- Dataset 4 in paper 10.1016/j.jct.2012.10.027 (Dataseries: 3, Datapoints: 40, Quantity: Refractive Index)
- Dataset 9 in paper 10.1016/j.jct.2016.06.026 (Dataseries: 3, Datapoints: 12, Quantity: Mass density)
- Dataset 10 in paper 10.1016/j.jct.2016.06.026 (Dataseries: 3, Datapoints: 12, Quantity: Speed of sound)
- Dataset 3 in paper 10.1016/j.jct.2016.12.033 (Dataseries: 3, Datapoints: 47, Quantity: Mass density)
- Dataset 4 in paper 10.1016/j.jct.2016.12.033 (Dataseries: 3, Datapoints: 47, Quantity: Dynamic viscosity)
- Dataset 10 in paper 10.1016/j.jct.2019.03.039 (Dataseries: 5, Datapoints: 35, Quantity: Mass density)
- Dataset 11 in paper 10.1016/j.jct.2019.03.039 (Dataseries: 5, Datapoints: 35, Quantity: Speed of sound)
- Dataset 12 in paper 10.1016/j.jct.2019.03.039 (Dataseries: 5, Datapoints: 35, Quantity: Dynamic viscosity)
- ethanol + thiamine hydrochloride + water (Datasets: 1)
- Dataset 1 in paper 10.1021/acs.jced.6b00613 (Dataseries: 8, Datapoints: 72, Quantity: Mole fraction)
- thiamine hydrochloride + propan-2-ol + water (Datasets: 1)
- Dataset 2 in paper 10.1021/acs.jced.6b00613 (Dataseries: 8, Datapoints: 64, Quantity: Mole fraction)
- D-xylose + thiamine hydrochloride + water (Datasets: 1)
- Dataset 1 in paper 10.1021/acs.jced.7b00937 (Dataseries: 4, Datapoints: 144, Quantity: Dynamic viscosity)
- xylitol + thiamine hydrochloride + water (Datasets: 1)
- Dataset 2 in paper 10.1021/acs.jced.7b00937 (Dataseries: 4, Datapoints: 96, Quantity: Dynamic viscosity)
- D-glucose + thiamine hydrochloride + water (Datasets: 1)
- Dataset 3 in paper 10.1021/acs.jced.7b00937 (Dataseries: 4, Datapoints: 128, Quantity: Dynamic viscosity)
- 2-deoxy-D-glucose + thiamine hydrochloride + water (Datasets: 1)
- Dataset 4 in paper 10.1021/acs.jced.7b00937 (Dataseries: 4, Datapoints: 96, Quantity: Dynamic viscosity)
- methyl-alpha-D-glucopyranoside + thiamine hydrochloride + water (Datasets: 1)
- Dataset 5 in paper 10.1021/acs.jced.7b00937 (Dataseries: 4, Datapoints: 128, Quantity: Dynamic viscosity)
- D-maltose + thiamine hydrochloride + water (Datasets: 1)
- Dataset 6 in paper 10.1021/acs.jced.7b00937 (Dataseries: 4, Datapoints: 128, Quantity: Dynamic viscosity)
- thiamine hydrochloride + sodium chloride + water (Datasets: 1)
- Dataset 3 in paper 10.1016/j.tca.2013.08.007 (Dataseries: 4, Datapoints: 132, Quantity: Mass density)
- thiamine hydrochloride + hydrogen chloride + water (Datasets: 2)
- Dataset 5 in paper 10.1016/j.jct.2007.04.009 (Dataseries: 6, Datapoints: 54, Quantity: Speed of sound)
- Dataset 6 in paper 10.1016/j.jct.2007.04.009 (Dataseries: 6, Datapoints: 54, Quantity: Mass density)
- 2-aminoacetic acid + thiamine hydrochloride + water (Datasets: 2)
- Dataset 1 in paper 10.1016/j.jct.2016.06.026 (Dataseries: 3, Datapoints: 108, Quantity: Mass density)
- Dataset 2 in paper 10.1016/j.jct.2016.06.026 (Dataseries: 3, Datapoints: 108, Quantity: Speed of sound)
- (S)-2-aminopropanoic acid + thiamine hydrochloride + water (Datasets: 2)
- Dataset 3 in paper 10.1016/j.jct.2016.06.026 (Dataseries: 3, Datapoints: 108, Quantity: Mass density)
- Dataset 4 in paper 10.1016/j.jct.2016.06.026 (Dataseries: 3, Datapoints: 108, Quantity: Speed of sound)
- thiamine hydrochloride + L-valine + water (Datasets: 2)
- Dataset 5 in paper 10.1016/j.jct.2016.06.026 (Dataseries: 3, Datapoints: 108, Quantity: Mass density)
- Dataset 6 in paper 10.1016/j.jct.2016.06.026 (Dataseries: 3, Datapoints: 108, Quantity: Speed of sound)
- L-leucine + thiamine hydrochloride + water (Datasets: 2)
- Dataset 7 in paper 10.1016/j.jct.2016.06.026 (Dataseries: 3, Datapoints: 108, Quantity: Mass density)
- Dataset 8 in paper 10.1016/j.jct.2016.06.026 (Dataseries: 3, Datapoints: 108, Quantity: Speed of sound)
- L-serine + thiamine hydrochloride + water (Datasets: 3)
- Dataset 1 in paper 10.1016/j.jct.2019.03.039 (Dataseries: 4, Datapoints: 140, Quantity: Mass density)
- Dataset 2 in paper 10.1016/j.jct.2019.03.039 (Dataseries: 4, Datapoints: 140, Quantity: Speed of sound)
- Dataset 3 in paper 10.1016/j.jct.2019.03.039 (Dataseries: 4, Datapoints: 140, Quantity: Dynamic viscosity)
- L-arginine + thiamine hydrochloride + water (Datasets: 3)
- Dataset 4 in paper 10.1016/j.jct.2019.03.039 (Dataseries: 4, Datapoints: 140, Quantity: Mass density)
- Dataset 5 in paper 10.1016/j.jct.2019.03.039 (Dataseries: 4, Datapoints: 140, Quantity: Speed of sound)
- Dataset 6 in paper 10.1016/j.jct.2019.03.039 (Dataseries: 4, Datapoints: 140, Quantity: Dynamic viscosity)