Cas no 997-95-5 (N-Nitrosodiisobutylamine)

N-Nitrosodiisobutylamine is a nitrosamine compound with the molecular formula C?H??N?O. It is primarily used in research and industrial applications, particularly in studies involving nitrosamine formation, toxicity, and carcinogenicity. The compound is of interest due to its structural properties, which allow for investigations into the mechanisms of N-nitrosamine-related chemical reactions. Its well-defined synthesis and stability under controlled conditions make it a reliable reference standard in analytical chemistry, particularly in gas chromatography (GC) and mass spectrometry (MS). Researchers value its consistent purity and reactivity profile for experimental reproducibility in environmental and toxicological studies. Proper handling is essential due to its potential hazardous nature.
N-Nitrosodiisobutylamine structure
N-Nitrosodiisobutylamine structure
Product Name:N-Nitrosodiisobutylamine
CAS No:997-95-5
MF:C8H18N2O
MW:158.241322040558
MDL:MFCD00210333
CID:805732
PubChem ID:13829
Update Time:2025-05-28

N-Nitrosodiisobutylamine Chemical and Physical Properties

Names and Identifiers

    • N,N-Diisobutylnitrous amide
    • 1-Propanamine,2-methyl-N-(2-methylpropyl)-N-nitroso-
    • N,N-bis(2-methylpropyl)nitrous amide
    • N-Nitrosodiisobutyla
    • N-nitrosodiisobutylamine
    • Diisobutylamine,N-nitroso
    • Diisobutylnitrosamin
    • Diisobutylnitrosamine
    • Diisobutyl-nitroso-amin
    • diisobutyl-nitroso-amine
    • Dmdpn
    • N,N-Diisobutylnitrosamine
    • Nitrosodiisobutylamine
    • N-nitroso-di-iso-butylamine
    • Dipropylamine,2,2'-dimethyl-N-nitroso- (6CI,7CI,8CI)
    • Diisobutylnitrosoamine
    • NSC 134
    • NSC134
    • NSC-134
    • SCHEMBL3195714
    • EINECS 213-644-4
    • Q27237216
    • Dipropylamine,2'-dimethyl-N-nitroso-
    • 0T0982G912
    • WLN: 1Y1&1NNO&1Y1&1
    • BRN 1760696
    • CHEMBL352481
    • D93202
    • Bisisobutyl-N-nitrosoamine
    • Diisobutylamine, N-nitroso-
    • FT-0651110
    • 2,2'-Dimethyldipropylnitrosoamine
    • nitrosodi-i-butylamine
    • EN300-7403034
    • DTXSID90244219
    • InChI=1/C8H18N2O/c1-7(2)5-10(9-11)6-8(3)4/h7-8H,5-6H2,1-4H
    • bis(2-methylpropyl)(nitroso)amine
    • N-Nitroso-2,2'-dimethyldi-n-propylamine
    • DIPROPYLAMINE, 2,2'-DIMETHYL-N-NITROSO-
    • N-isobutyl-2-methyl-N-nitrosopropan-1-amine
    • XLZCLFRMPCBSDI-UHFFFAOYSA-N
    • 1,1-Diisobutyl-2-oxohydrazine #
    • N-NITROSO-DIISOBUTYLAMINE
    • N,N-Diisobutylnitrousamide
    • 1-Propanamine, 2-methyl-N-(2-methylpropyl)-N-nitroso-
    • Di-iso-butylnitrosamine
    • N,N-DIISOBUTYLNITROSOAMINE
    • NS00042650
    • 997-95-5
    • AKOS006273045
    • AS-77938
    • N-Nitrosodi-iso-butylamine
    • UNII-0T0982G912
    • DB-007775
    • N-Nitrosodiisobutylamine
    • MDL: MFCD00210333
    • Inchi: 1S/C8H18N2O/c1-7(2)5-10(9-11)6-8(3)4/h7-8H,5-6H2,1-4H3
    • InChI Key: XLZCLFRMPCBSDI-UHFFFAOYSA-N
    • SMILES: O=NN(CC(C)C)CC(C)C

Computed Properties

  • Exact Mass: 158.14200
  • Monoisotopic Mass: 158.141913
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 5
  • Complexity: 103
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 32.7

Experimental Properties

  • Color/Form: Not determined
  • Density: 0.92±0.1 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 237.7±9.0 oC (760 Torr),
  • Flash Point: 97.5±18.7 oC,
  • Refractive Index: 1.4540 (estimate)
  • Solubility: Slightly soluble (3.5 g/l) (25 o C),
  • PSA: 32.67000
  • LogP: 2.28180
  • Solubility: Not determined

N-Nitrosodiisobutylamine Security Information

N-Nitrosodiisobutylamine Customs Data

  • HS CODE:2928000090
  • Customs Data:

    China Customs Code:

    2928000090

    Overview:

    2928000090 Other hydrazine(Hydrazine)And chlorhexidine(hydroxylamine)Organic derivatives of.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:6.5%.general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2928000090 other organic derivatives of hydrazine or of hydroxylamine VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

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N-Nitrosodiisobutylamine Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
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(CAS:997-95-5)N-Nitrosodiisobutylamine
Order Number:LE11740
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:05
Price ($):discuss personally
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Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:997-95-5)N-Nitrosodiisobutylamine
LE11740
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
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