N-Nitrosodiethanolamine - ≥97%(GC) , CAS No.1116-54-7

CAS: 1116-54-7 Cat. No.: N159088 Peso molecular: 134.14 Número EC: 214-237-4
Disponible para pedir
GRADE & PURITY ≥97%(GC)
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
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
N159088-1g
5
102,90US$
5g
N159088-5g
1
292,90US$
25g
N159088-25g
1
815,90US$
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥97%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Argon charged 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
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
Especificaciones y pureza
≥97%(GC)
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C, Argon charged
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥97%(GC)
Nombres e identificadores
Pubchem Sid504752533
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504752533
Sonrisas canónicasC(CO)N(CCO)N=O
IUPAC NameN,N-bis(2-hydroxyethyl)nitrous amide
InChIKeyYFCDLVPYFMHRQZ-UHFFFAOYSA-N
INCHI1S/C4H10N2O3/c7-3-1-6(5-9)2-4-8/h7-8H,1-4H2
Isómeros SMILES C(CO)N(CCO)N=O
RTECS KL9550000
Número ONU 1993
Grupo de embalaje I
Peso molecular 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

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic nitrogen compounds
ClaseOrganonitrogen compounds
SubclassOrganic nitroso compounds
Intermediate Tree Nodes Not available
Direct ParentOrganic N-nitroso compounds
Alternative Parents Alkanolamines  Primary alcohols  Organopnictogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic 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
DescripciónThis 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
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
NR3C1 Tclin Glucocorticoid receptor (14987 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KCNH2 Tclin HERG (29587 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Lymphoblastoid cell (5959 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Skin (286 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.

9 results found

Lot NumberCertificate TypeFechaArticulo
C2210223Certificate of AnalysisSep 09, 2025 N159088
C2210224Certificate of AnalysisSep 09, 2025 N159088
C2210225Certificate of AnalysisSep 09, 2025 N159088
I2312742Certificate of AnalysisFeb 28, 2025 N159088
I2312768Certificate of AnalysisFeb 28, 2025 N159088
I2312769Certificate of AnalysisFeb 28, 2025 N159088
I2312770Certificate of AnalysisFeb 28, 2025 N159088
K2414332Certificate of AnalysisApr 13, 2024 N159088
G2327048Certificate of AnalysisMar 19, 2022 N159088
Propiedades químicas y físicas
Solubilidadsoluble in water.
SensibilidadAir & Heat Sensitive
Índice de refracción1.50
Punto de inflamación (°C)181 °C
Punto de ebullición (°C)114 °C/1.4 mmHg
Peso molecular134.130 g/mol
XLogP3-1.500
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass134.069 Da
Monoisotopic Mass134.069 Da
Topological Polar Surface Area73.100 Ų
Heavy Atom Count9
Formal Charge0
Complexity72.200
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
Preguntas frecuentes y artículos
Citations of This Product
Referencias
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]
Calculadoras de soluciones
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