Product Name: Nitrosoundecylurea (CAS NO.71752-67-5)
Molecular Formula: C12H25N3O2
Molecular Weight: 243.40g/mol
Mol File: 71752-67-5.mol
Boiling point: 338.9 °C at 760 mmHg
Flash Point: 158.8 °C
Density: 1.04 g/cm3
Surface Tension: 39.8 dyne/cm
Enthalpy of Vaporization: 58.23 kJ/mol
Vapour Pressure: 9.53E-05 mmHg at 25°C
XLogP3-AA: 4.4
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of Nitrosoundecylurea (CAS NO.71752-67-5):
IUPAC Name: 1-nitroso-1-undecylurea
Canonical SMILES: CCCCCCCCCCCN(C(=O)N)N=O
InChI: InChI=1S/C12H25N3O2/c1-2-3-4-5-6-7-8-9-10-11-15(14-17)12(13)16/h2-11H2,1H3,(H2,13,16)
InChIKey: NAUXWGBUEVOAKV-UHFFFAOYSA-N
1. | mmo-sat 1 µg/plate | MUREAV Mutation Research. 68 (1979),1. | ||
2. | mma-sat 100 µg/plate | TCMUE9 Topics in Chemical Mutagenesis. 1 (1984),13. |
Questionable carcinogen with experimental carcinogenic data. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. See also N-NITROSO COMPOUNDS.
Nitrosoundecylurea , its CAS NO. is 71752-67-5, the synonyms are Urea, N-nitroso-N-undecyl- ; CID135505 .
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