N-3-Methylbutyl-N-1-methyl acetonylnitrosamine supplier

Name
N-3-methylbutyl-N-1-methylacetonylnitrosamine
EINECS
CAS No. 71016-15-4
Density 1.01g/cm³
Solubility
Melting Point
Formula C9H18 N2 O2
Boiling Point 295°C at 760 mmHg
Molecular Weight 186.29
Flash Point 132.2°C
Transport Information
Appearance
Safety Suspected carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. Mutation data reported. When heated to decomposition it emits toxic fumes of NO_x. See also NITROSAMINES.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms MAMBNA;N-(1-Methylacetonyl)-N-(3-methylbutyl)nitrosamine
PSA 49.74000
LogP 1.99340

N-3-Methylbutyl-N-1-methyl acetonylnitrosamine Chemical Properties

Molecule structure of N-3-Methylbutyl-N-1-methyl acetonylnitrosamine (CAS NO.71016-15-4):

IUPAC Name: N-(3-Methylbutyl)-N-(3-oxobutan-2-yl)nitrous amide
Molecular Weight: 186.25142 g/mol
Molecular Formula: C₉H₁₈N₂O₂
Density: 1.01 g/cm³
Boiling Point: 295 °C at 760 mmHg
Flash Point: 132.2 °C
Index of Refraction: 1.476
Molar Refractivity: 51.99 cm³
Molar Volume: 184 cm³
Polarizability: 20.61×10^-24 cm³
Surface Tension: 31.7 dyne/cm
Enthalpy of Vaporization: 53.47 kJ/mol
Vapour Pressure: 0.00157 mmHg at 25 °C
XLogP3-AA: 2
H-Bond Acceptor: 4
Rotatable Bond Count: 5
Tautomer Count: 3
Exact Mass: 186.136828
MonoIsotopic Mass: 186.136828
Topological Polar Surface Area: 49.7
Heavy Atom Count: 13
Complexity: 181
Canonical SMILES: CC(C)CCN(C(C)C(=O)C)N=O
InChI: InChI=1S/C9H18N2O2/c1-7(2)5-6-11(10-13)8(3)9(4)12/h7-8H,5-6H2,1-4H3
InChIKey of N-3-Methylbutyl-N-1-methyl acetonylnitrosamine (CAS NO.71016-15-4): SJEKZTPKCBODER-UHFFFAOYSA-N

N-3-Methylbutyl-N-1-methyl acetonylnitrosamine Toxicity Data With Reference

1.		mma-sat 2 g/L		CRNGDP Carcinogenesis. 1 (1980),867.
2.		otr-ham:lng 500 mg/L		SSBSEF Scientia Sinica, Series B: Chemical, Biological, Agricultural, Medical, and Earth Sciences (English Edition). 25 (1982),738.

N-3-Methylbutyl-N-1-methyl acetonylnitrosamine Safety Profile

Suspected carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. Mutation data reported. When heated to decomposition it emits toxic fumes of NO_x. See also NITROSAMINES.

N-3-Methylbutyl-N-1-methyl acetonylnitrosamine Specification

N-3-Methylbutyl-N-1-methyl acetonylnitrosamine (CAS NO.71016-15-4) is also named as 3-((Isopentyl)nitrosoamino)-2-butanone ; BRN 5924833 ; Mambna ; 2-Butanone, 3-((3-methylbutyl)nitrosoamino)- ; 2-Butanone, 3-((isopentyl)nitrosoamino)- .

Product Name

N-3-methylbutyl-N-1-methylacetonylnitrosamine

N-3-Methylbutyl-N-1-methyl acetonylnitrosamine Chemical Properties

N-3-Methylbutyl-N-1-methyl acetonylnitrosamine Toxicity Data With Reference

N-3-Methylbutyl-N-1-methyl acetonylnitrosamine Safety Profile

N-3-Methylbutyl-N-1-methyl acetonylnitrosamine Specification

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