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Structure

2-Methyl-3-propylbenzothiazolium iodide

CAS
60126-29-6
Catalog Number
ACM60126296
Category
Other Products
Molecular Weight
319.21
Molecular Formula
C11H14INS

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Specification

Synonyms
2-Deoxytubercidin, CID6453914, Benzothiazolium, 2-methyl-propyl-, iodide, 60126-29-6
IUPAC Name
3-(2-methylpropyl)-1,3-benzothiazol-3-ium iodide
Canonical SMILES
CCC[N+]1=C(SC2=CC=CC=C21)C.[I-]
InChI Key
ZHSORAHGHZOKDH-UHFFFAOYSA-M
Melting Point
173-176ºC(lit.)
Exact Mass
318.98900
Hazard Statements
Xi
H-Bond Acceptor
1
H-Bond Donor
0
Safety Description
26-37/39
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