CAS 924-16-3 | N-Nitrosodibutylamine | CAS Number 924-16-3

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924-16-3 | N-Nitrosodibutylamine

CAS No: 924-16-3 Catalog No: AG003T8W MDL No:MFCD00013892

Product Description

Catalog Number:

AG003T8W

Chemical Name:

N-Nitrosodibutylamine

CAS Number:

924-16-3

Molecular Formula:

C8H18N2O

Molecular Weight:

158.2413

MDL Number:

MFCD00013892

IUPAC Name:

N,N-dibutylnitrous amide

InChI:

InChI=1S/C8H18N2O/c1-3-5-7-10(9-11)8-6-4-2/h3-8H2,1-2H3

InChI Key:

YGJHZCLPZAZIHH-UHFFFAOYSA-N

SMILES:

CCCCN(N=O)CCCC

EC Number:

213-101-1

UNII:

8K8942WN31

NSC Number:

6830

UN Number:

3082

Properties

Complexity:

88.1

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

158.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

158.245g/mol

Monoisotopic Mass:

158.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

32.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6

Literature

Title	Journal
Analysis of N-nitrosamines in water by isotope dilution gas chromatography-electron ionisation tandem mass spectrometry.	Talanta 20120915
Occurrence and source of nitrosamines and secondary amines in groundwater and its adjacent Jialu River basin, China.	Environmental science & technology 20120320
[Investigation on the levels of carbon-, nitrogen-, iodine-containing disinfection by-products in a water plant in Jiangsu province, China].	Zhonghua yu fang yi xue za zhi [Chinese journal of preventive medicine] 20120201
Pressurised hot water extraction followed by headspace solid-phase microextraction and gas chromatography-tandem mass spectrometry for the determination of N-nitrosamines in sewage sludge.	Talanta 20120115
Occurrence of nine nitrosamines and secondary amines in source water and drinking water: Potential of secondary amines as nitrosamine precursors.	Water research 20111015
Biotransformation of nitrosamines and precursor secondary amines under methanogenic conditions.	Environmental science & technology 20111001
Determination of eight nitrosamines in water at the ng L(-1) levels by liquid chromatography coupled to atmospheric pressure chemical ionization tandem mass spectrometry.	Analytica chimica acta 20110919
Determination of nitrosamines in water by gas chromatography/chemical ionization/selective ion trapping mass spectrometry.	Journal of chromatography. A 20110408
N-Nitrosamines (15 listings): N-Nitrosodi-n-butylamine.	Report on carcinogens : carcinogen profiles 20110101
Pathobiology and chemoprevention of bladder cancer.	Journal of oncology 20110101
Determination of volatile nitrosamines in various meat products using comprehensive gas chromatography-nitrogen chemiluminescence detection.	Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20101101
Screening of N-nitrosamines in tap and swimming pool waters using fast gas chromatography.	Journal of separation science 20100301
N-Nitrosopiperidine and N-Nitrosodibutylamine induce apoptosis in HepG2 cells via the caspase dependent pathway.	Cell biology international 20091201
Myricetin, quercetin, (+)-catechin and (-)-epicatechin protect against N-nitrosamines-induced DNA damage in human hepatoma cells.	Toxicology in vitro : an international journal published in association with BIBRA 20091001
Detection and toxicity assessment of nitrosamines migration from latex gloves in the Chinese market.	International journal of hygiene and environmental health 20090901
Antiapoptotic effects of dietary antioxidants towards N-nitrosopiperidine and N-nitrosodibutylamine-induced apoptosis in HL-60 and HepG2 cells.	Journal of applied toxicology : JAT 20090701
Identification of N-nitrosamines in treated drinking water using nanoelectrospray ionization high-field asymmetric waveform ion mobility spectrometry with quadrupole time-of-flight mass spectrometry.	Journal of chromatographic science 20090101
Chemoprevention of rat liver toxicity and carcinogenesis by Spirulina.	International journal of biological sciences 20090101
Synergistic potentiation of D-fraction with vitamin C as possible alternative approach for cancer therapy.	International journal of general medicine 20090101
Organosulfur compounds alone or in combination with vitamin C protect towards N-nitrosopiperidine- and N-nitrosodibutylamine-induced oxidative DNA damage in HepG2 cells.	Chemico-biological interactions 20080509
Induction of apoptosis and reactive oxygen species production by N-nitrosopiperidine and N-nitrosodibutylamine in human leukemia cells.	Journal of applied toxicology : JAT 20080501
Protective effects of isothiocyanates alone or in combination with vitamin C towards N-nitrosodibutylamine or N-nitrosopiperidine-induced oxidative DNA damage in the single-cell gel electrophoresis (SCGE)/HepG2 assay.	Journal of applied toxicology : JAT 20080301
Nitrosamine carcinogens also swim in chlorinated pools.	Environmental science & technology 20080215
Protective effect of vitamin C towards N-nitrosamine-induced DNA damage in the single-cell gel electrophoresis (SCGE)/HepG2 assay.	Toxicology in vitro : an international journal published in association with BIBRA 20071001
Evaluating the impacts of membrane type, coating, fouling, chemical properties and water chemistry on reverse osmosis rejection of seven nitrosoalklyamines, including NDMA.	Water research 20070901
Photochemical attenuation of N-nitrosodimethylamine (NDMA) and other nitrosamines in surface water.	Environmental science & technology 20070901
Analysis of nitrosamines by capillary electrospray-high-field asymmetric waveform ion mobility spectrometry-MS with programmed compensation voltage.	Electrophoresis 20070501
Fate and transport of N-nitrosamines under conditions simulating full-scale groundwater recharge operations.	Water environment research : a research publication of the Water Environment Federation 20061201
Molecular characterization of tumor associated antigen in mice exposed to a hepatocarcinogen.	Molecular and cellular biochemistry 20050301
N-nitrosodi-n-butylamine.	Report on carcinogens : carcinogen profiles 20040101
High susceptibility of p53 knockout mice to esophageal and urinary bladder carcinogenesis induced by N, N-dibutylnitrosamine.	Cancer letters 20030508
Correlation between induction of DNA fragmentation in urinary bladder cells from rats and humans and tissue-specific carcinogenic activity.	Toxicology 20020930
N-Nitrosodi-n-butylamine.	Report on carcinogens : carcinogen profiles 20020101
Cytochrome b(5) coexpression increases the CYP2E1-dependent mutagenicity of dialkylnitrosamines in methyltransferase-deficient strains of Salmonella typhimurium.	Mutation research 20011212
Role of human cytochrome P450 (CYP) in the metabolic activation of N-alkylnitrosamines: application of genetically engineered Salmonella typhimurium YG7108 expressing each form of CYP together with human NADPH-cytochrome P450 reductase.	Mutation research 20011101
Mutagenicity of nitrosamines in methyltransferase-deficient strains of Salmonella typhimurium coexpressing human cytochrome P450 2E1 and reductase.	Mutation research 20001106
Identification of the cytochrome P450 isozymes involved in the metabolism of N-nitrosodipropyl-,N-nitrosodibutyl- and N-nitroso-n-butyl-n-propylamine.	Carcinogenesis 19960401
Different modifying responses of capsaicin in a wide-spectrum initiation model of F344 rat.	Journal of Korean medical science 19910301
Activation of N-ras gene in a rat hepatocellular carcinoma induced by dibutylnitrosamine and butylated hydroxytoluene.	Japanese journal of cancer research : Gann 19870701
Effect of sodium phenobarbital and sodium saccharin in AIN-76A diet on carcinogenesis initiated with N-[4-(5-nitro-2-furyl)-2-thiazolyl]formamide and N,N-dibutylnitrosamine in male F344 rats.	Cancer research 19861201