2-Methyl-1,3-dithiolane - Reagent grade , CAS No.5616-51-3

CAS: 5616-51-3 Cat. No.: M479180 分子式: C4H8S2 分子量: 120.24 EC番号: 227-038-2
注文可能
GRADE & PURITY Reagent Grade ? General reagent-grade purity suitable for most laboratory work. Use as a dependable default when no specific higher grade is required.
Synonyms
1,3-Dithiolane,2-methyl- | 2-Methyl-1,3-dithiacyclopentane | DTXSID8063963 | NSC 227863 | 4O81R0SPR0 | F75650 | InChI=1/C4H8S2/c1-4-5-2-3-6-4/h4H,2-3H2,1H | AKOS025396842 | FEMA No. 3705 | CARJCVDELAMAEJ-UHFFFAOYSA-N | MFCD01729666 | 1,3-DITHIOLANE, 2-MET
Storage
Room temperature
★
Size
USA
ドイツ (EU)*
Price
Qty
250mg
M479180-250mg
受注生産 · 8~12週間

$130.90

$153.90
保存 $23.00 (14.94%)
Enter a quantity for the sizes you want to add.
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Why this grade

Reagent grade Reagent Grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

同義語
1,3-Dithiolane,2-methyl- | 2-Methyl-1,3-dithiacyclopentane | DTXSID8063963 | NSC 227863 | 4O81R0SPR0 | F75650 | InChI=1/C4H8S2/c1-4-5-2-3-6-4/h4H,2-3H2,1H | AKOS025396842 | FEMA No. 3705 | CARJCVDELAMAEJ-UHFFFAOYSA-N | MFCD01729666 | 1,3-DITHIOLANE, 2-MET
仕様と純度
Reagent grade
保管条件
Room temperature
等級
Reagent Grade
名前と識別子
カノニカル・スマイル
CC1SCCS1
IUPAC Name
2-methyl-1,3-dithiolane
InChIKey
CARJCVDELAMAEJ-UHFFFAOYSA-N
INCHI
1S/C4H8S2/c1-4-5-2-3-6-4/h4H,2-3H2,1H3
異性体SMILES
CC1SCCS1
分子量
120.24
Reaxy-Rn
102524
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=102524&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
分類Dithiolanes
Subclass1,3-dithiolanes
Intermediate Tree Nodes Not available
Direct Parent1,3-dithiolanes
Alternative Parents Dithioacetals  Dialkylthioethers  Hydrocarbon derivatives  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents 1,3-dithiolane - Thioacetal - Dialkylthioether - Thioether - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
説明This compound belongs to the class of organic compounds known as 1,3-dithiolanes. These are organic compounds containing a 1,3-dithiolane ring. 1,3-dithiolane moiety is a 5-membered saturated aliphatic ring with three carbon atoms, and two sulfur atoms at the 1- and 3- ring positions.
External Descriptors Not available
3 D構造
インタラクティブ化学構造モデル





証明書(CoA、COO、BSE/TSEと分析図)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
化学的性質と物理的性質
引火点(°F)Not applicable
引火点(°C)Not applicable
分子量120.200 g/mol
XLogP31.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass120.007 Da
Monoisotopic Mass120.007 Da
Topological Polar Surface Area50.600 Ų
Heavy Atom Count6
Formal Charge0
Complexity38.800
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
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