Basic information
- CAS
106259-87-4- Standard SMILES
Cc1cc(N)n(-c2c(Cl)cc(Cl)cc2Cl)n1- InChIKey
ABLOGSPAFQBNMG-UHFFFAOYSA-N- Molecular formula
- C10H8Cl3N3
- Average molar mass
- 276.5 g/mol
- Monoisotopic mass
- 274.9783803
Names & identifiers
- Preferred name
- 3-Methyl-1-(2,4,6-trichlorophenyl)-1H-pyrazol-5-amine
- IUPAC
- 5-methyl-2-(2,4,6-trichlorophenyl)pyrazol-3-amine
- English name
- 5-Methyl-2-(2,4,6-trichlorophenyl)-2H-pyrazol-3-ylamine
- Molecular formula
- C10H8Cl3N3
- Molecular weight
- 276.55
Names & synonyms
106259-87-43-Methyl-1-(2,4,6-trichlorophenyl)-1H-pyrazol-5-amineDTXSID80366131RefChem:280602DTXCID103171715-methyl-2-(2,4,6-trichlorophenyl)-2h-pyrazol-3-ylamine5-Methyl-2-(2,4,6-trichlorophenyl)-2H-pyrazol-3-yl amine5-methyl-2-(2,4,6-trichlorophenyl)pyrazol-3-amine1H-Pyrazol-5-amine,3-methyl-1-(2,4,6-trichlorophenyl)-MFCD030937853-amino-2-(2,4,6-trichlorophenyl)-5-methylpyrazoleSCHEMBL5826687
Show more names
5-AMINO-3-METHYL-1-(2,4,6-TRICHLOROPHENYL)PYRAZOLE5-Methyl-2-(2,4,6-trichlorophenyl)-2H-pyrazol-3-yl5-METHYL-2-(2,4,6-TRICHLOROPHENYL)PYRAZOL-3-YL-AMINE1-(2,4,6-trichlorophenyl)-3-methyl-1H-pyrazol-5-amine1H-Pyrazol-5-amine, 3-methyl-1-(2,4,6-trichlorophenyl)-2-methyl-5-oxo-1-(2,4,6-trichlorophenyl)-1,2,4-triazole-3-carboxylate
ABLOGSPAFQBNMG-UHFFFAOYSA-NAKOS001047414FS-6349CS-0339539F79930F005968SR-01000041870SR-01000041870-1
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- Boiling point
- 419.2 · 419.2±45.0 °C(Predicted)
- Density
- 1.57 · 1.57±0.1 g/cm3(Predicted)
- pka
- 2.72 · 2.72±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H332-H312-H315-H335-H302
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
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, P317, 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
- H319-H332-H312-H315-H335-H302
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers8 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海药禾平生物医药科技有限公司57540919 13120888836 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
Related reactions
16 records
Compound notes
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