Product Number: 1037292
CAS Registry Number 1037-29-2
(Component: 130967-52-1)
Name:
Thiazolium, 5-[2-(acetyloxy)ethyl]-3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-, chloride, hydrochloride (1:1:1)
Thiamine, acetate (ester), monohydrochloride (8CI)
Thiamine, acetate, hydrochloride (7CI)
Thiazolium, 5-[2-(acetyloxy)ethyl]-3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-, chloride, monohydrochloride (9CI)
Chemical Formula: C14H20Cl2N4O2S
Exact Mass: 378.07
Molecular Weight: 379.31
m/z: 378.07 (100.0%), 380.07 (64.7%), 379.07 (17.7%), 382.06 (13.1%), 381.07 (10.6%), 380.06 (4.5%), 383.07 (1.7%), 381.06 (1.5%), 382.07 (1.2%), 380.08 (1.1%)
InChI:InChI=1S/C14H19N4O2S.2ClH/c1-9-13(4-5-20-11(3)19)21-8-18(9)7-12-6-16-10(2)17-14(12)15;;/h6,8H,4-5,7H2,1-3H3,(H2,15,16,17);2*1H/q+1;;/p-1
InChI Key:RHACBYQHDIYAIL-UHFFFAOYSA-M
Canonical SMILES:CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCOC(=O)C.Cl.[Cl-]
| Thermal Properties |
Value |
Condition |
Note |
| Melting Point |
225-227 °C (decomp) |
Solv: ethanol (64-17-5) |
(2)CAS |
| Melting Point |
225-226 °C |
|
(3)CAS |
| Melting Point |
220-222 °C (decomp) |
|
(4)CAS |
| Melting Point |
220 °C (decomp) |
Solv: ethanol, 90% (64-17-5) |
(5)CAS |
|
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