Catalog No.:AA0032XL

40018-26-6 | 1,4-Dithiane-2,5-diol

Name: Name:1,4-Dithiane-2,5-diol
Brand: AABLOCKS
SKU: AA0032XL
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Technical Information
Properties
Literature
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Technical Information
Properties
Literature

Technical Information

Catalog Number:

AA0032XL

Chemical Name:

1,4-Dithiane-2,5-diol

CAS Number:

40018-26-6

Molecular Formula:

C4H8O2S2

Molecular Weight:

152.2351

MDL Number:

MFCD00006659

SMILES:

OC1SCC(SC1)O

NSC Number:

106280

FEMA Number:

3826

Properties

BP:

360.9°C at 760 mmHg

Form:

Solid

MP:

130 °C (dec.)(lit.)

Refractive Index:

1.5200 (estimate)

Solubility:

H2O: 0.39% at 20 °C

Storage:

Inert atmosphere;2-8℃;

Computed Properties

Complexity:

68.4

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Undefined Atom Stereocenter Count:

XLogP3:

0.3

Literature

Title: Hydrogen-bond-mediated cascade reaction involving chalcones: facile synthesis of enantioenriched trisubstituted tetrahydrothiophenes.

Journal: Organic letters 20120217

Title: Menin-MLL inhibitors reverse oncogenic activity of MLL fusion proteins in leukemia.

Journal: Nature chemical biology 20120129

Title: (R)-2-(2-Methoxy-phen-yl)-2,5-dihydro-thio-phene-3-carbaldehyde.

Journal: Acta crystallographica. Section E, Structure reports online 20100201

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SDS