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1,3-Dithiane

1,3-Dithiane Structure
CAS No.
505-23-7
Chemical Name:
1,3-Dithiane
Synonyms
1,3-Dithian;M-DITHIANE;1,3-DITHIANE;1,3-Dithane;Dithiane-1,3;META-DITHIANE;1,3-Dithiane>1,3-Dithiane,97%;1,3-Dithiane,99%;1,3-Dithiane,98%
CBNumber:
CB6223805
Molecular Formula:
C4H8S2
Molecular Weight:
120.24
MOL File:
505-23-7.mol
MSDS File:
SDS
Modify Date:
2023/5/25 18:01:14

1,3-Dithiane Properties

Melting point 52-54 °C (lit.)
Boiling point 207-208°C
Density 1.062 (estimate)
refractive index 1.5981 (estimate)
Flash point 195 °F
storage temp. Inert atmosphere,Room Temperature
form Crystals, Needles or Powder
pka 31(at 25℃)
color White to pale beige
Odor at 0.01 % in propylene glycol. alliaceous roasted
Odor Type alliaceous
Water Solubility Soluble in benzene, ether, chloroform and terahydrofuran. Slightly soluble in water.
Sensitive Hygroscopic
BRN 102534
InChIKey WQADWIOXOXRPLN-UHFFFAOYSA-N
LogP 1.729 (est)
CAS DataBase Reference 505-23-7(CAS DataBase Reference)
NIST Chemistry Reference 1,3-Dithiane(505-23-7)

SAFETY

Risk and Safety Statements

Symbol(GHS) 
GHS02
Signal word  Warning
Hazard statements  H228
Precautionary statements  P210-P240-P241-P280
Risk Statements  20/21/22
Safety Statements  22-24/25
RIDADR  UN 1325 4.1/PG 2
WGK Germany  3
RTECS  JO5070000
13
HazardClass  4.1
PackingGroup  III
HS Code  29349990
NFPA 704
0
1 0

1,3-Dithiane price More Price(7)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich(India) 157872 1,3-Dithiane 97% 505-23-7 5G ₹3615.55 2022-06-14 Buy
Sigma-Aldrich(India) 157872 1,3-Dithiane 97% 505-23-7 25G ₹12621.95 2022-06-14 Buy
ALFA India ALF-A10505-22 1,3-Dithiane, 98% 505-23-7 100g ₹46781 2022-05-26 Buy
ALFA India ALF-A10505-14 1,3-Dithiane, 98% 505-23-7 25g ₹14160 2022-05-26 Buy
ALFA India ALF-A10505-06 1,3-Dithiane, 98% 505-23-7 5g ₹7325 2022-05-26 Buy
Product number Packaging Price Buy
157872 5G ₹3615.55 Buy
157872 25G ₹12621.95 Buy
ALF-A10505-22 100g ₹46781 Buy
ALF-A10505-14 25g ₹14160 Buy
ALF-A10505-06 5g ₹7325 Buy

1,3-Dithiane Chemical Properties,Uses,Production

Chemical Properties

white to pale beige crystals, needles or powder

Uses

1,3-Dithiane is used in umpolung reactions such as the Corey-Seebach reaction. It acts as a reagent for the deoxygenation of sulfoxides to their corresponding sulfides. Further, it is used as a protecting group for carbonyl compounds used in organic synthesis. It serves as a useful labeled synthon. In addition to this, it is used in the preparation of 2-ethyl-[1,3]dithiane.

Reactions

1,3-dithiane has 2 weakly acidic protons that can be removed and alkylation of the carbon is possible. Once alkylated, the 1,3-dithiane becomes a “protected” carbonyl as it can be hydrolyzed to the corresponding carbonyl structure. Alternatively, the 1,3-dithiane moiety may also be introduced by thioacetalisation of a carbonyl group, either using acid or Lewis acid catalysis, 12 or of a 1,1-dihalide (using transition metal catalysis).

General Description

1,3-Dithiane, a protected formaldehyde anion equivalent, serves as useful labeled synthon.

Purification Methods

Crystallise the 1,3-dithiane from 1.5 times its weight of MeOH at 0o, and sublime it at 40-50o/0.1mm. [Groel & Seebach Synthesis 357 1977, Beilstein 19/1 V 13.]

1,3-Dithiane Preparation Products And Raw materials

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