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acetylthiamine

acetylthiamine structure

CAS No:
3419-28-1
Formula:
C14H19ClN4O2S
Chemical Name:
acetylthiamine
Synonyms:
acetylthiamine;thiamine acetate ester;DTXSID70955730;5-(2-Acetoxyethyl)-3-((4-amino-2-methylpyrimidin-5-yl)methyl)-4-methylthiazol-3-ium chloride;5-[2-(Acetyloxy)ethyl]-3-[(6-imino-2-methyl-1,6-dihydropyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium chloride;Thiazolium, 5-(2-(acetyloxy)ethyl)-3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-4-methyl-, chloride

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acetylthiamine Basic Attributes

Molecular Weight：

342.842

Exact Mass：

342.092

Characteristics

PSA：

110

XLogP3：

-1.88740

Drug Information

MeSH Entry Terms：

acetylthiamine

Computed Properties

Molecular Weight:342.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:342.0917247
Monoisotopic Mass:342.0917247
Topological Polar Surface Area:110
Heavy Atom Count:22
Complexity:358
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of acetylthiamine

Basic Attributes
Characteristics
Drug Information
Computed Properties

acetylthiamine

SDS

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