Molecular Identity
Thiamine Hydrochloride
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride
PubChem CID: 6202
2D Structure
Properties
C12H18Cl2N4OS
Molecular Formula
337.30
Molecular Weight
g/mol
336.0578
Exact Mass
Da
104
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
6
H-Bond Acceptors
268
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]Isomeric SMILES
SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]Synonyms(20)
THIAMINE HYDROCHLORIDE67-03-8Thiamine HCLAneurine hydrochlorideVitamin B1 hydrochlorideClotiaminaEskaphenBetalin SThiamine chloride hydrochlorideThiamine dichlorideBevitineBenervaThiamin chlorideThiaminum hydrochloricumThiamin hydrochloride
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Thiamine Hydrochloride
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