3,5-Dimethylpyrazole-1-carboxamidine monohydrochloride
Basic information
- CAS
40027-64-3- Standard SMILES
Cc1cc(C)n(C(=N)N)n1.Cl- InChIKey
UOLOESWKXGHYCY-UHFFFAOYSA-N- Molecular formula
- C6H11ClN4
- Average molar mass
- 174.63 g/mol
- Monoisotopic mass
- 174.0672241
Names & identifiers
- Preferred name
- 3,5-Dimethylpyrazole-1-carboxamidine monohydrochloride
- IUPAC
- 3,5-dimethylpyrazole-1-carboximidamide;hydrochloride
- English name
- 3,5-Dimethyl-1H-pyrazole-1-carboxamidin&
- Molecular formula
- C6H11ClN4
- Molecular weight
- 174.63
Names & synonyms
3,5-Dimethylpyrazole-1-carboxamidine monohydrochlorideRefChem:48695140027-64-33,5-Dimethyl-1H-pyrazole-1-carboximidamide hydrochloridePyrazole-1-carboxamidine, 3,5-dimethyl-, monohydrochloride3,5-dimethylpyrazole-1-carboximidamide hydrochloride3,5-Dimethyl-1H-pyrazole-1-carboxamidine hydrochloride1-Guanyl-3,5-dimethylpyrazole hydrochloride3,5-dimethylpyrazole-1-carboximidamide;hydrochlorideY6BB2E5H2UNSC-51109CHEMBL553974
Show more names
1-ARMA-4183WLN: T5NNJ AYZUM C1 E1 &..H..N-O33,5-dimethyl-1-pyrazolecarboxamidine3,5-dimethylpyrazole-1-carboximidamide3,5-Dimethyl-1H-pyrazol-1-carboximidamide HClPyrazole-1-carboxamidine, 3,5-dimethyl-, nitrate3,5-DiMethyl-1-pyrazolylforMaMidiniuM hydrochloride
NSC 51109MFCD01693599UNII-Y6BB2E5H2USCHEMBL6943796DTXSID20193089UOLOESWKXGHYCY-UHFFFAOYSA-NNSC51109QBA02764
Database identifiers
- CAS
40027-64-3- PubChem CID
- 218002
- DTXSID
DTXSID20193089- ChEMBL
CHEMBL553974- UNII
- Y6BB2E5H2U
- EC Number
- 826-434-8
Properties
Computed structural properties
- Topological polar surface area
- 67.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 145
Physicochemical properties
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 6 BB2E5H2U · Y6BB2E5H2U
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H302-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
- Hazard Codes
- Xi
- Risk Statements
- 43 · 43
- Safety Statements
- 36 · 36/37-24/25-22
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)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- risk_code
- 43
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 36/37-24/25-22
- Hazard statements
- H335-H302-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
2 records
Compound notes
Loading…