1-(2-Chlorobenzyl)-1H-pyrazol-3-amine
Basic information
- CAS
492426-32-1- Standard SMILES
Nc1ccn(Cc2ccccc2Cl)n1- InChIKey
JCONEINCKQOFEC-UHFFFAOYSA-N- Molecular formula
- C10H10ClN3
- Average molar mass
- 207.66 g/mol
- Monoisotopic mass
- 207.056325
Names & identifiers
- Preferred name
- 1-(2-Chlorobenzyl)-1H-pyrazol-3-amine
- IUPAC
- 1-[(2-chlorophenyl)methyl]pyrazol-3-amine
- English name
- 1-[(2-Chlorophenyl)methyl]pyrazol-3-amine
- Molecular formula
- C10H10ClN3
- Molecular weight
- 207.66
Names & synonyms
1-(2-Chlorobenzyl)-1H-pyrazol-3-amine492426-32-11-[(2-chlorophenyl)methyl]pyrazol-3-amine1-[(2-chlorophenyl)methyl]-1h-pyrazol-3-amineMFCD020564961-(2-Chloro-benzyl)-1 H -pyrazol-3-ylamine1-[(2-chlorophenyl)methyl]pyrazole-3-ylamineOprea1_337306JCONEINCKQOFEC-UHFFFAOYSA-NSUA42632SBB019801STK348782
Show more names
-[(2-Chlorophenyl)methyl]pyrazol-3-amine1H-Pyrazol-3-amine, 1-[(2-chlorophenyl)methyl]-
AKOS000304526Pyrazol-3-amine, 1-(2-chlorobenzyl)-SY081003VS-092941-(2-chlorobenzyl)-1H-pyrazol-3-ylamine1-(2-Chlorobenzyl)-1H-pyrazol-3-amine #1-(2-Chloro-benzyl)-1H-pyrazol-3-ylamineST45162784
Database identifiers
- CAS
492426-32-1- PubChem CID
- 599015
- EC Number
- 182-210-3
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 188
Physicochemical properties
- Boiling point
- 398.2 · 398.2±27.0 °C(Predicted)
- Density
- 1.31 · 1.31±0.1 g/cm3(Predicted)
- pka
- 3.8 · 3.80±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…