Thiamine phosphate ester dihydrogen phosphate salt

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Catalog Number

ACM635972

Product Name

Structure

CAS

635-97-2

Category

Heterocyclic Organic Compound

Synonyms

EINECS 211-246-5, CID3033991, Thiamine phosphate ester dihydrogen phosphate salt, 635-97-2

IUPAC Name

2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl dihydrogen phosphate; dihydrogen phosphate

Molecular Weight

442.321722 [g/mol]

Molecular Formula

C₁₂H₁₈N₄O₄PS.H₂O₄P

Canonical SMILES

CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCOP(=O)(O)O.OP(=O)(O)O.[Cl-]

InChI Key

CUWOKLAYADTBBR-UHFFFAOYSA-N

EC Number

211-246-5

Exact Mass

442.04800

H-Bond Acceptor

H-Bond Donor

MSDS

COA

Spec Sheet

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