Basic information
- CAS
35799-08-7- Standard SMILES
CCCCCCCCN(N=O)C(N)=N[N+](=O)[O-]- InChIKey
AOZCQGYQFGAKBG-UHFFFAOYSA-N- Molecular formula
- C9H19N5O3
- Average molar mass
- 245.28 g/mol
- Monoisotopic mass
- 245.14878949
Names & identifiers
- Preferred name
- Guanidine, 2-nitro-1-nitroso-1-octyl-
- IUPAC
- 2-nitro-1-nitroso-1-octylguanidine
Names & synonyms
35799-08-7GUANIDINE, 2-NITRO-1-NITROSO-1-OCTYL-DTXSID20189321BRN 1987717N-Nitroso-N'-nitro-N-octylguanidine2-Nitro-1-nitroso-1-octyl-guanidineRefChem:346978DTXCID50111812Guanidine, N''-nitro-N-nitroso-N-octyl-N''-NITRO-N-NITROSO-N-OCTYLGUANIDINE
Database identifiers
- CAS
35799-08-7- PubChem CID
- 37265
- DTXSID
DTXSID20189321- EC Number
- 636-867-2
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 264
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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