Basic information
- CAS
257946-84-2- Standard SMILES
O=NN(Cc1ccccc1)C1CC1- InChIKey
DIADEYURNVUSGN-UHFFFAOYSA-N- Molecular formula
- C10H12N2O
- Average molar mass
- 176.21 g/mol
- Monoisotopic mass
- 176.09496301
Names & identifiers
- Preferred name
- N-benzyl-N-nitrosocyclopropanamine
- IUPAC
- N-benzyl-N-cyclopropylnitrous amide
Names & synonyms
N-benzyl-N-nitrosocyclopropanamine257946-84-2N-benzyl-N-cyclopropylnitrous amideEBC-395091EN300-36970742
Database identifiers
- CAS
257946-84-2- PubChem CID
- 10702425
- EC Number
- 175-858-3
- Nikkaji
- J1.254.952K
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
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]
P203, P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification 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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