2-(4-amino-1H-pyrazol-1-yl)-N,N-dimethylacetamide
Basic information
- CAS
1152841-77-4- Standard SMILES
CN(C)C(=O)Cn1cc(N)cn1- InChIKey
AURGRUDLXONNHV-UHFFFAOYSA-N- Molecular formula
- C7H12N4O
- Average molar mass
- 168.2 g/mol
- Monoisotopic mass
- 168.10111102
Names & identifiers
- Preferred name
- 2-(4-amino-1H-pyrazol-1-yl)-N,N-dimethylacetamide
- IUPAC
- 2-(4-aminopyrazol-1-yl)-N,N-dimethylacetamide
Names & synonyms
2-(4-amino-1H-pyrazol-1-yl)-N,N-dimethylacetamide1152841-77-4RefChem:456652842-859-12-(4-aminopyrazol-1-yl)-N,N-dimethylacetamide2-(4-Amino-1-pyrazolyl)-N,N-dimethylacetamideSCHEMBL1703729AURGRUDLXONNHV-UHFFFAOYSA-NCWB84177MFCD11128203AKOS000205346CCG-209977
Show more names
DA-21281SY186070EN300-66657G24795
Database identifiers
- CAS
1152841-77-4- PubChem CID
- 28280666
- EC Number
- 842-859-1
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 171
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
H303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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. 5 (100%)
Related reactions
3 records
Compound notes
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