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Structure

2',3'-O-Isopropylidene-6-thioinosine

CAS
5856-48-4
Catalog Number
ACM5856484
Category
Other Products
Molecular Weight
324.36
Molecular Formula
C13H16N4O4S

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Specification

Synonyms
MLS000738072, NSC27305, MolPort-004-964-669, EINECS 227-474-3, 2,3-O-Isopropylidene-6-thioinosine, CID3034499, SMR000393744, 5856-48-4
IUPAC Name
9-[6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-3H-purine-6-thione
Canonical SMILES
CC1(OC2C(OC(C2O1)N3C=NC4=C3NC=NC4=S)CO)C
InChI Key
HXZCOKXEDYVENB-UHFFFAOYSA-N
Boiling Point
603.7ºC at 760 mmHg
Flash Point
318.9ºC
Density
1.78g/cm³
EC Number
227-474-3
Exact Mass
324.08900
H-Bond Acceptor
6
H-Bond Donor
2
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