The store will not work correctly when cookies are disabled.
JavaScript seems to be disabled in your browser. For the best experience on our site, be sure to turn on Javascript in your browser.
· · COA & SDS available for every product · Same-day shipping on in-stock items Molinate - analytical standard , CAS No.2212-67-1
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. Synonyms
MOLINATE|2212-67-1|Ordram|S-Ethyl azepane-1-carbothioate|Jalan|Yalan|Yulan|Higalnate|Molmate|Hydram|Felan|S-Ethyl hexahydro-1H-azepine-1-carbothioate|Ethyl 1-hexamethyleneiminecarbothiolate|S-Ethyl N,N-hexamethylenethiocarbamate|S-Ethyl hexahydroazepine-1
Shipped In
Wet ice,FedEx DG Service
🧪
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,FedEx DG Service 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
MOLINATE | 2212-67-1 | Ordram | S-Ethyl azepane-1-carbothioate | Jalan | Yalan | Yulan | Higalnate | Molmate | Hydram | Felan | S-Ethyl hexahydro-1H-azepine-1-carbothioate | Ethyl 1-hexamethyleneiminecarbothiolate | S-Ethyl N, N-hexamethylenethiocarbamate | S-Ethyl hexahydroazepine-1
Specifications & Purity
analytical standard
Shipped In
Wet ice, FedEx DG Service
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles CCSC(=O)N1CCCCCC1 IUPAC Name S-ethyl azepane-1-carbothioate InChIKey DEDOPGXGGQYYMW-UHFFFAOYSA-N INCHI 1S/C9H17NOS/c1-2-12-9(11)10-7-5-3-4-6-8-10/h2-8H2,1H3 Isomeric SMILES CCSC(=O)N1CCCCCC1 WGK Germany 3 RTECS CM2625000 UN Number 2902 Packing Group I Molecular Weight 187.3 Beilstein 1239196 Reaxy-Rn 1239196 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1239196&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 Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Azepanes Subclass Not available Intermediate Tree Nodes Not available Direct Parent Azepanes Alternative Parents Thiocarbamic acid derivatives Organic carbonic acids and derivatives Sulfenyl compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic heteromonocyclic compounds Substituents Azepane - Thiocarbamic acid derivative - Carbonic acid derivative - Azacycle - Sulfenyl compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as azepanes. These are organic compounds containing a saturated seven member heterocycle, with one nitrogen atom. External Descriptors Thiocarbamate herbicides Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Refractive Index 1.5124 Flash Point(°C) 100 °C Boil Point(°C) 202°C Molecular Weight 187.300 g/mol XLogP3 3.200 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 2 Exact Mass 187.103 Da Monoisotopic Mass 187.103 Da Topological Polar Surface Area 45.600 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 141.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
Citations of This Product References 1. Manman Qin, Leting Wang, Kaixin Xu, Zhehao Liang, Chao Zhong, Yanfei Xie, Dan Shan, Jun Yu, Jiang Wang, Hao Fan. (2025) Rapid identification of high-viscosity rice soup quality using neutral desorption extractive electrospray ionization mass spectrometry. Analytical Methods, [PMID:40758120 ] [10.1039/D5AY00420A ]
Solution Calculators Molarity Calculator Determine the necessary mass, volume, or concentration for preparing a solution.
Dilution Calculator Determine the dilution needed to prepare a stock solution.
Reconstitution Calculator Reviews
We use cookies to ensure the website functions properly and, where permitted, to improve your experience. You can manage your preferences at any time in Settings. Learn more in our
Cookie Policy. Settings Agree All Decline
Shall we send you a message when we have discounts available?
Remind me later Allow
Thank you! Please check your email inbox to confirm.
Oops! Notifications are disabled.
Products are supplied to verified businesses, institutions, and qualified professionals for research and development use only. Not for use in humans, animals, diagnosis, or therapy.
Copyright © 2023–present Aladdin Scientific Corp. All rights reserved.
K22171008