4-Phenylthiomorpholine 1,1-Dioxide - ≥96% , CAS No.17688-68-5

CAS: 17688-68-5 Cat. No.: P160317 Molecular Weight: 211.28 Beilstein Registry Number: 27(3/4)644 EC Number: 241-675-3 PubChem CID: 87241
AVAILABLE TO ORDER
GRADE & PURITY ≥96%
Synonyms
4-PHENYL-1??-THIOMORPHOLINE-1,1-DIONE | AKOS015961439 | SCHEMBL2456271 | EINECS 241-675-3 | 4-phenyl-1,4-thiazinane 1,1-dioxide | FT-0637588 | NSC 261427 | Oprea1_801485 | MFCD00100136 | AS-63610 | T71939 | N-Phenylthiomorpholine S,S-dioxide | AMY20759 |
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
P160317-1g
3
$69.90
5g
P160317-5g
2
$115.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal 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

Synonyms
4-PHENYL-1??-THIOMORPHOLINE-1, 1-DIONE | AKOS015961439 | SCHEMBL2456271 | EINECS 241-675-3 | 4-phenyl-1, 4-thiazinane 1, 1-dioxide | FT-0637588 | NSC 261427 | Oprea1_801485 | MFCD00100136 | AS-63610 | T71939 | N-Phenylthiomorpholine S, S-dioxide | AMY20759 |
Specifications & Purity
≥96%
Storage
Room temperature
Shipped In
Normal
Purity
≥96%
Names and Identifiers
Pubchem Sid488186408
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488186408
Canonical SmilesC1CS(=O)(=O)CCN1C2=CC=CC=C2
IUPAC Name4-phenyl-1,4-thiazinane 1,1-dioxide
InChIKeyOLQHDKQJHKZUNN-UHFFFAOYSA-N
INCHI1S/C10H13NO2S/c12-14(13)8-6-11(7-9-14)10-4-2-1-3-5-10/h1-5H,6-9H2
Isomeric SMILES C1CS(=O)(=O)CCN1C2=CC=CC=C2
RTECS XM3050025
PubChem CID 87241
Molecular Weight 211.28
Beilstein 27(3/4)644
Reaxy-Rn 154714

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.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassThiazinanes
SubclassThiomorpholines
Intermediate Tree Nodes Not available
Direct ParentPhenylthiomorpholines
Alternative Parents Dialkylarylamines  Aniline and substituted anilines  Sulfones  Azacyclic compounds  Organopnictogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents 4-phenylthiomorpholine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Sulfone - Tertiary amine - Azacycle - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenylthiomorpholines. These are compounds containing a thiomorpholine ring conjugated to a phenyl group. Thiomorpholine a six-membered aliphatic ring containing one nitrogen atom and one sulfur atom at positions 1 and 4 respectively, and four carbon atoms.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot NumberCertificate TypeDateItem
H2322750Certificate of AnalysisJun 09, 2026 P160317
H2322751Certificate of AnalysisJun 09, 2026 P160317
H2322752Certificate of AnalysisJun 09, 2026 P160317
H2322753Certificate of AnalysisJun 09, 2026 P160317
Chemical and Physical Properties
Melt Point(°C)120 °C
Molecular Weight211.280 g/mol
XLogP30.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass211.067 Da
Monoisotopic Mass211.067 Da
Topological Polar Surface Area45.800 Ų
Heavy Atom Count14
Formal Charge0
Complexity261.000
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
Solution Calculators
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