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Thiamine Pyrophosphate Chloride

Product Code

TRC-T344070

CAS Number

154-87-0

Product Format

Neat

Molecular Formula

C12 H19 N4 O7 P2 S . Cl

Molecular Weight

460.77

API Family

Thiamine

Product Type

Impurity

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Product Information

Product Data

Analyte Name

Thiamine pyrophosphate chloride

CAS Number

154-87-0

Molecular Formula

C12 H19 N4 O7 P2 S . Cl

Molecular Weight

460.77

Accurate Mass

460.0138

SMILES

[Cl-].Cc1ncc(C[n+]2csc(CCOP(=O)(O)OP(=O)(O)O)c2C)c(N)n1

InChI

/h5,7H,3-4,6H2,1-2H3,(H4-,13,14,15,17,18,19,20,21), InChI=1S/C12H18N4O7P2S.ClH/c1-8-11(3-4-22-25(20,21)23-24(17,18)19)26-7-16(8)6-10-5-14-9(2)15-12(10)13, 1H

IUPAC

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

Alternate CAS Number

Thiazolium: 136-08-3; Inner salt: 136-09-4

Storage & Transport Information

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Attributes

Product Type

Impurity

Product Format

Neat

API Family

Thiamine

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