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Details

Stereochemistry ACHIRAL
Molecular Formula C4H8S2
Molecular Weight 120.236
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-DITHIANE

SMILES

C1CSCSC1

InChI

InChIKey=WQADWIOXOXRPLN-UHFFFAOYSA-N
InChI=1S/C4H8S2/c1-2-5-4-6-3-1/h1-4H2

HIDE SMILES / InChI

Molecular Formula C4H8S2
Molecular Weight 120.236
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
3,9-Diisopropyl-2,4,8,10-tetra-thia-spiro-[5.5]undeca-ne.
2010-09-25
The vibrational spectra of 1,3-dithiane-1-oxide and 1,3-dithia-1-oxocyclohept-5-ene.
2010-09-15
Chemistry around imidazopyrazine and ibuprofen: discovery of novel fatty acid amide hydrolase (FAAH) inhibitors.
2010-09
Stereoselective synthesis of bioactive natural spiroacetals aculeatins A and B.
2010-04-01
1,3-Dithian-2-one azine.
2010-03-27
Use of 1,3-dithiane combined with aryldiazonium cation for immobilization of biomolecules based on electrochemical addressing.
2009-08-28
Au(PPh(3))Cl-AgSbF(6)-catalyzed rearrangement of propargylic 1,3-dithianes: formation of 8-membered 1,3-bisthio-substituted cyclic allenes.
2009-05-14
[(1R,3S)-3-(1,3-Dithian-2-yl)-2,2-dimethyl-cyclo-prop-yl]diphenyl-methanol.
2009-05-07
Effect of sulfur oxidation on the transmission mechanism of 4J(HH) NMR coupling constants in 1,3-dithiane.
2009-03-19
2-(4-Nitro-phen-yl)-1,3-dithiane.
2009-01-17
Lewis base catalyzed 1,3-dithiane addition to carbonyl and imino compounds using 2-trimethylsilyl-1,3-dithiane.
2008-09-01
Synthesis and evaluation of the cytotoxicity of apoptolidinones A and D.
2008-07-04
Synthesis of 5-hydroxy-2,3,4,5-tetrahydro-[1H]-2-benzazepin-4-ones: selective antagonists of muscarinic (M3) receptors.
2008-06-21
4-(5-tert-Butyl-1,3-dithian-2-yl)-5-chloro-2-phenyl-1,3-oxazole.
2008-02-06
Conformational landscape of meso-(1,3-dithian-2-yl)porphyrins.
2007-08-03
Computational study of 1,3-dithiane 1,1-dioxide (1,3-dithiane sulfone). Description of the inversion process and manifestation of stereoelectronic effects on 1JC-H coupling constants.
2006-06-22
[1,3]Dithian-2-ylidene.
2006-06-12
Preparation and application of odorless 1,3-propanedithiol reagents.
2006-01
Light-directed radial combinatorial chemistry: orthogonal safety-catch protecting groups for the synthesis of small molecule microarrays.
2004-12-29
Thermochemistry of 1,3-dithiacyclohexane 1-oxide (1,3-dithiane sulfoxide): calorimetric and computational study.
2004-08-06
Evolution of dithiane-based strategies for the construction of architecturally complex natural products.
2004-06
Calorimetric and computational study of 1,3-dithiacyclohexane 1,1-dioxide (1,3-dithiane sulfone).
2004-03-05
A practical and efficient synthesis of the C-16-C-28 spiroketal fragment (CD) of the spongistatins.
2003-12-11
A novel method for the preparation of alpha,alpha'-difluoroesters and acids using BrF3.
2003-10-17
Novel method for incorporating the CHF(2) group into organic molecules using BrF(3).
2003-03-06
Naphthalene analogues of lignans.
2003-02-07
Application of the chiral acyl anion equivalent, trans-1,3-dithiane 1,3-dioxide, to an asymmetric synthesis of (R)-salbutamol.
2002-11-29
A new approach to the reduction of sulfoxides to sulfides with 1,3-dithiane in the presence of electrophilic bromine as catalyst.
2002-05-03
A novel synthesis of branched high-molecular-weight (C40+) long-chain alkanes.
2002-03
Mass-spectrometric analysis of agonist-induced retinoic acid receptor gamma conformational change.
2002-02-15
Enantiomeric 1,2,3-trithiane-containing alkaloids and two new 1,3-dithiane alkaloids from New Zealand ascidians.
2001-11-30
Electronic delocalization contribution to the anomeric effect evaluated by computational methods.
2001-05-04
Versatile 8-oxabicyclo[3.2.1]oct-6-en-3-one: stereoselective methodology for generating C-glycosides, delta-valerolactones, and polyacetate segments.
2001-01-25
Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:56:21 GMT 2025
Edited
by admin
on Mon Mar 31 18:56:21 GMT 2025
Record UNII
63527N060G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-157830
Preferred Name English
1,3-DITHIANE
Systematic Name English
M-DITHIANE
Systematic Name English
1,3-DITHIACYCLOHEXANE
Systematic Name English
DITHIANE-1,3
Common Name English
Code System Code Type Description
FDA UNII
63527N060G
Created by admin on Mon Mar 31 18:56:21 GMT 2025 , Edited by admin on Mon Mar 31 18:56:21 GMT 2025
PRIMARY
EPA CompTox
DTXSID40198516
Created by admin on Mon Mar 31 18:56:21 GMT 2025 , Edited by admin on Mon Mar 31 18:56:21 GMT 2025
PRIMARY
NSC
157830
Created by admin on Mon Mar 31 18:56:21 GMT 2025 , Edited by admin on Mon Mar 31 18:56:21 GMT 2025
PRIMARY
CAS
505-23-7
Created by admin on Mon Mar 31 18:56:21 GMT 2025 , Edited by admin on Mon Mar 31 18:56:21 GMT 2025
PRIMARY
PUBCHEM
10451
Created by admin on Mon Mar 31 18:56:21 GMT 2025 , Edited by admin on Mon Mar 31 18:56:21 GMT 2025
PRIMARY
MESH
C012947
Created by admin on Mon Mar 31 18:56:21 GMT 2025 , Edited by admin on Mon Mar 31 18:56:21 GMT 2025
PRIMARY
ECHA (EC/EINECS)
208-006-7
Created by admin on Mon Mar 31 18:56:21 GMT 2025 , Edited by admin on Mon Mar 31 18:56:21 GMT 2025
PRIMARY
CHEBI
47845
Created by admin on Mon Mar 31 18:56:21 GMT 2025 , Edited by admin on Mon Mar 31 18:56:21 GMT 2025
PRIMARY