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· · COA & SDS available for every product · Same-day shipping on in-stock items N-Nitrosodiethanolamine - ≥97%(GC) , CAS No.1116-54-7
Synonyms
NCGC00091047-01 | N-NITROSODIETHANOLAMINE [HSDB] | CHEBI:82357 | NCI-C55583 | SCHEMBL1288208 | Diethanolnitrosamine | N-Nitrosoaminodiethanol | AKOS006228419 | HSDB 4180 | N-Nitrosobis(2-hydroxyethyl)amine | Bi(2-hydroxyethyl)nitrosoamine | N-NITROSODIETH
Storage
Store at 2-8°C,Argon charged
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Why this grade ≥97%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C,Argon charged 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
NCGC00091047-01 | N-NITROSODIETHANOLAMINE [HSDB] | CHEBI:82357 | NCI-C55583 | SCHEMBL1288208 | Diethanolnitrosamine | N-Nitrosoaminodiethanol | AKOS006228419 | HSDB 4180 | N-Nitrosobis(2-hydroxyethyl)amine | Bi(2-hydroxyethyl)nitrosoamine | N-NITROSODIETH
Specifications & Purity
≥97%(GC)
Storage
Store at 2-8°C, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Pubchem Sid 504752533 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504752533 Canonical Smiles C(CO)N(CCO)N=O IUPAC Name N,N-bis(2-hydroxyethyl)nitrous amide InChIKey YFCDLVPYFMHRQZ-UHFFFAOYSA-N INCHI 1S/C4H10N2O3/c7-3-1-6(5-9)2-4-8/h7-8H,1-4H2 Isomeric SMILES C(CO)N(CCO)N=O RTECS KL9550000 UN Number 1993 Packing Group I Molecular Weight 134.14 Reaxy-Rn 1762620 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1762620&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 Organic nitrogen compounds Class Organonitrogen compounds Subclass Organic nitroso compounds Intermediate Tree Nodes Not available Direct Parent Organic N-nitroso compounds Alternative Parents Alkanolamines Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents Organic n-nitroso compound - Alkanolamine - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound Description This compound belongs to the class of organic compounds known as organic n-nitroso compounds. These are organic compounds containing a n-nitroso group -NN=O. External Descriptors nitroso compound 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) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility soluble in water. Sensitivity Air & Heat Sensitive Refractive Index 1.50 Flash Point(°C) 181 °C Boil Point(°C) 114 °C/1.4 mmHg Molecular Weight 134.130 g/mol XLogP3 -1.500 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 4 Exact Mass 134.069 Da Monoisotopic Mass 134.069 Da Topological Polar Surface Area 73.100 Ų Heavy Atom Count 9 Formal Charge 0 Complexity 72.200 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
Documents & Articles Citations of This Product References 1. He Ying, Ding Haotian, Xia Xingya, Qi Wenyi, Wang Huaisong, Liu Wenyuan, Zheng Feng. (2021) GFP-fused yeast cells as whole-cell biosensors for genotoxicity evaluation of nitrosamines. APPLIED MICROBIOLOGY AND BIOTECHNOLOGY, 105 (13): (5607-5616). [PMID:34228183 ] [10.1007/s00253-021-11426-4 ]
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