1-((oxolan-3-yl)methyl)-1H-pyrazol-3-amine
Basic information
- CAS
1248173-28-5- Standard SMILES
Nc1ccn(CC2CCOC2)n1- InChIKey
UNSDDPKYYYBZPH-UHFFFAOYSA-N- Molecular formula
- C8H13N3O
- Average molar mass
- 167.21 g/mol
- Monoisotopic mass
- 167.10586205
Names & identifiers
- Preferred name
- 1-((oxolan-3-yl)methyl)-1H-pyrazol-3-amine
- IUPAC
- 1-(oxolan-3-ylmethyl)pyrazol-3-amine
Names & synonyms
1-[(oxolan-3-yl)methyl]-1H-pyrazol-3-amine1248173-28-51-((oxolan-3-yl)methyl)-1H-pyrazol-3-amineRefChem:418868863-318-61-(oxolan-3-ylmethyl)pyrazol-3-amineYZB17328AKOS010566732EN300-2181521-((Tetrahydrofuran-3-yl)methyl)-1H-pyrazol-3-amineZ802830878
Database identifiers
- CAS
1248173-28-5- PubChem CID
- 61312633
- EC Number
- 863-318-6
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 153
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…