Aldicarb-sulfoxide - analytical standard , CAS No.1646-87-3

CAS: 1646-87-3 Cat. No.: A135548 Molecular Weight: 206.26 Beilstein Registry Number: 2212914 EC Number: 622-554-8
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GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
2H-1-Benzopyran-2-one, 4-methyl-7-(b-D-xylopyranosyloxy)- | Temik sulfoxide | UNII-7XX24C9Y7X | BRN 1962013 | [(E)-(2-methyl-2-methylsulfinylpropylidene)amino] N-methylcarbamate | NCGC00090719-01 | 1ST20273 | J35.502J | NCGC00090719-03 | (1E)-2-methyl-2-(
Storage
Store at 2-8°C
Shipped In
Wet ice
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Size
Status
Price
Qty
100mg
A135548-100mg
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Why this grade

analytical standard Analytical standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at 2-8°C Ships Wet ice 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.

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Literature proof

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

Specifications

Synonyms
2H-1-Benzopyran-2-one, 4-methyl-7-(b-D-xylopyranosyloxy)- | Temik sulfoxide | UNII-7XX24C9Y7X | BRN 1962013 | [(E)-(2-methyl-2-methylsulfinylpropylidene)amino] N-methylcarbamate | NCGC00090719-01 | 1ST20273 | J35.502J | NCGC00090719-03 | (1E)-2-methyl-2-(
Specifications & Purity
analytical standard
Storage
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Grade
Analytical standard
Names and Identifiers
Canonical SmilesCC(C)(C=NOC(=O)NC)S(=O)C
IUPAC Name[(E)-(2-methyl-2-methylsulfinylpropylidene)amino] N-methylcarbamate
InChIKeyBXPMAGSOWXBZHS-WEVVVXLNSA-N
INCHI1S/C7H14N2O3S/c1-7(2,13(4)11)5-9-12-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+
Isomeric SMILES CC(C)(/C=N/OC(=O)NC)S(=O)C
WGK Germany 3
RTECS UE2075000
Molecular Weight 206.26
Beilstein 2212914
Reaxy-Rn 1962013
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1962013&ln=

Documentation

📋 Safety Data Sheet (SDS)

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

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✅ 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
SuperclassOrganic nitrogen compounds
ClassOrganonitrogen compounds
SubclassOxime carbamates
Intermediate Tree Nodes Not available
Direct ParentOxime carbamates
Alternative Parents Sulfoxides  Organic carbonic acids and derivatives  Aldoximes  Sulfinyl compounds  Organopnictogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Oxime carbamate - Sulfoxide - Aldoxime - Carbonic acid derivative - Sulfinyl compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as oxime carbamates. These are oxime ether derivatives with the general formula CC(R)=NOC(=O)N(R')R\", where R-R\" = H or organyl.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
THRB Tclin Thyroid hormone receptor beta-1 (7926 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HSD17B10 Tchem Endoplasmic reticulum-associated amyloid beta-peptide-binding protein (20669 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SNCA Tchem Alpha-synuclein (10960 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight206.270 g/mol
XLogP3-0.200
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass206.073 Da
Monoisotopic Mass206.073 Da
Topological Polar Surface Area87.000 Ų
Heavy Atom Count13
Formal Charge0
Complexity238.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds1
Covalently-Bonded Unit Count1
Solution Calculators
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