7068-83-9
Product Name:
METHYLBUTYLNITROSAMINE
Formula:
C5H12N2O
Synonyms:
Methylbutylnitrosamine
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CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Liquid; [Sigma-Aldrich MSDS] |
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Boiling Point | 193.6 °C |
Flash Point | 32.6 °C |
Vapor Density | 1 |
Vapor Pressure | 0.21 [mmHg] |
Kovats Retention Index | 1540.7 |
Chemical Classes | Nitrogen Compounds -> Nitrosamines |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Skull and Crossbones Acute Toxicity GHS06 Health Hazard GHS08 |
GHS Hazard Statements |
H301:Acute toxicity,oral H350:Carcinogenicity |
Precautionary Statement Codes |
P201:Obtain special instructions before use. P202:Do not handle until all safety precautions have been read and understood. P260:Do not breathe dust/fume/gas/mist/vapours/spray. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
COMPUTED DESCRIPTORS
Molecular Weight | 116.16 g/mol |
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XLogP3 | 1.4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 3 |
Exact Mass | 116.094963011 g/mol |
Monoisotopic Mass | 116.094963011 g/mol |
Topological Polar Surface Area | 32.7 Ų |
Heavy Atom Count | 8 |
Formal Charge | 0 |
Complexity | 65.4 |
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 |