924-46-9
Product Name:
METHYL N-PROPYL NITROSAMINE
Formula:
C4H10N2O
Synonyms:
MPN;PRSS27;Serine protease 27
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CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Liquid; [Sigma-Aldrich MSDS] |
|---|---|
| Kovats Retention Index | 887 |
| Chemical Classes | Nitrogen Compounds -> Nitrosamines |
COMPUTED DESCRIPTORS
| Molecular Weight | 102.14 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 102.079312947 g/mol |
| Monoisotopic Mass | 102.079312947 g/mol |
| Topological Polar Surface Area | 32.7 Ų |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 55.7 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |