Basic information
- CAS
75881-19-5- Standard SMILES
CCCCCCCCCN(C)N=O- InChIKey
KLLCUFCZOSHJRP-UHFFFAOYSA-N- Molecular formula
- C10H22N2O
- Average molar mass
- 186.29 g/mol
- Monoisotopic mass
- 186.17321333
Overview
structure given in first source
Names & identifiers
- Preferred name
- N-Methyl-N-nitroso-1-nonanamine
- IUPAC
- N-methyl-N-nonylnitrous amide
- English name
- N-nitrosomethylnonylamine
- Molecular formula
- C10H22N2O
- Molecular weight
- 186.29
Names & synonyms
N-Nitrosomethylnonylamine75881-19-5N-Methyl-N-nitroso-1-nonanamine1-Nonanamine, N-methyl-N-nitroso-20L6P42L7GRefChem:164017N-methyl-N-nonylnitrous amideNitrosomethyl-n-nonylamineNitroso-N-methyl-n-nonylamineCCRIS 13671-Nonylamine, N-methyl-N-nitroso-NONYLAMINE, N-METHYL-N-NITROSO-
Show more names
N-Nitroso-N-methylnonylamineUNII-20L6P42L7GDTXSID80997267Q27253467
Database identifiers
- CAS
75881-19-5- PubChem CID
- 53393
- DTXSID
DTXSID80997267- UNII
- 20L6P42L7G
- Nikkaji
- J64.706C
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 117
Physicochemical properties
- Boiling point
- 320.8 °C · 320.8°C (rough estimate)
- Density
- 0.9698 · 0.9698 (rough estimate)
- refractive index
- 1.471 · 1.4710 (estimate)
- pka
- -3.41 · -3.41±0.70(Predicted)
- FDA UNII
- 20 L6P42L7G · 20L6P42L7G
- Toxicity
- 25 mg/plate · mma-sat 25 mg/plate TCMUD8 1,295,80
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationHazard Traits - Carcinogenicity
Safety data
- Toxicity
- mma-sat 25 mg/plate TCMUD8 1,295,80
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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