Propetamphos - analytical standard , CAS No.31218-83-4

CAS: 31218-83-4 Cat. No.: P114179 Peso molecular: 281.31 Beilstein Registry Number: 1979853 Número EC: 250-517-2
Disponible para pedir
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
SAN 52139 | Sandoz 52139 | Tox21_300863 | W-110796 | E-Propetamphos | isopropyl (E)-3-(((ethylamino)(methoxy)phosphorothioyl)oxy)but-2-enoate | O-(1-Isopropoxycarbonyl-1-propen-2-yl)-O-methyl N-ethyl-phosphoramidothionate | DTXCID5012470 | NCGC00163952-02
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
25mg
P114179-25mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
172,90US$
100mg
P114179-100mg
1

529,90US$

686,90US$
Guardar 157,00 US$ (22.86%)
Enter a quantity for the sizes you want to add.
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Why this grade

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

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

📋

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

Sinónimos
SAN 52139 | Sandoz 52139 | Tox21_300863 | W-110796 | E-Propetamphos | isopropyl (E)-3-(((ethylamino)(methoxy)phosphorothioyl)oxy)but-2-enoate | O-(1-Isopropoxycarbonyl-1-propen-2-yl)-O-methyl N-ethyl-phosphoramidothionate | DTXCID5012470 | NCGC00163952-02
Especificaciones y pureza
analytical standard
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Grado
Analytical standard
Nombres e identificadores
Sonrisas canónicasCCNP(=S)(OC)OC(=CC(=O)OC(C)C)C
IUPAC Namepropan-2-yl (E)-3-[ethylamino(methoxy)phosphinothioyl]oxybut-2-enoate
InChIKeyBZNDWPRGXNILMS-VQHVLOKHSA-N
INCHI1S/C10H20NO4PS/c1-6-11-16(17,13-5)15-9(4)7-10(12)14-8(2)3/h7-8H,6H2,1-5H3,(H,11,17)/b9-7+
Isómeros SMILES CCNP(=S)(OC)O/C(=C/C(=O)OC(C)C)/C
WGK Alemania 3
RTECS GQ4750000
Número ONU 3018
Grupo de embalaje I
Peso molecular 281.31
Beilstein 1979853
Reaxy-Rn 2280373
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2280373&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
SuperclassLipids and lipid-like molecules
ClaseFatty Acyls
SubclassFatty acid esters
Intermediate Tree Nodes Not available
Direct ParentFatty acid esters
Alternative Parents Thiophosphoric acid esters  Enoate esters  Monocarboxylic acids and derivatives  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Fatty acid ester - Thiophosphoric acid ester - Organic thiophosphoric acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonyl group - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aliphatic acyclic compound
DescripciónThis compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
External Descriptors Phosphoramido insecticides
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
THRB Tclin Thyroid hormone receptor beta-1 (7926 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AHR Tclin Aryl hydrocarbon receptor (1071 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NR1H4 Tclin Bile acid receptor FXR (6228 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
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.

1 results found

Lot NumberCertificate TypeFechaArticulo
C23161319Certificate of AnalysisDec 10, 2024 P114179
Propiedades químicas y físicas
Índice de refracción1.495
Punto de ebullición (°C)87-89°C
Punto de fusión (°C)87-89°C
Peso molecular281.310 g/mol
XLogP32.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass281.085 Da
Monoisotopic Mass281.085 Da
Topological Polar Surface Area88.900 Ų
Heavy Atom Count17
Formal Charge0
Complexity330.000
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
Calculadoras de soluciones
Reseñas

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