Basic information
- CAS
19541-96-9- Standard SMILES
Cc1cc(N)n(-c2ccccn2)n1- InChIKey
BDTNHFVPZQIZFD-UHFFFAOYSA-N- Molecular formula
- C9H10N4
- Average molar mass
- 174.2 g/mol
- Monoisotopic mass
- 174.09054632
Names & identifiers
- Preferred name
- 3-Methyl-1-(pyridin-2-yl)-1H-pyrazol-5-amine
- IUPAC
- 5-methyl-2-pyridin-2-ylpyrazol-3-amine
- English name
- 5-Methyl-2-pyridin-2-yl-2H-pyrazol-3-ylamine
- Molecular formula
- C9H10N4
- Molecular weight
- 174.2
Names & synonyms
19541-96-93-methyl-1-(pyridin-2-yl)-1H-pyrazol-5-amineDTXSID00352738RefChem:280628DTXCID20303803830-225-75-Methyl-2-pyridin-2-yl-2H-pyrazol-3-ylamineMFCD027084345-methyl-2-pyridin-2-ylpyrazol-3-amine3-methyl-1-pyridin-2-yl-1H-pyrazol-5-amineF3099-56713-methyl-1-(2-pyridyl)pyrazole-5-ylamine
Show more names
5-methyl-2-(2-pyridyl)pyrazol-3-amine1H-Pyrazol-5-amine, 3-methyl-1-(2-pyridinyl)-3-methyl-1-pyridin-2-yl-1H-pyrazol-5-amine(SALTDATA: FREE)
3-methyl-1-(2-pyridinyl)-1H-Pyrazol-5-amine3-methyl-1-(2-pyridinyl)-1H-pyrazol-5-ylamineOprea1_868503MLS000762760SCHEMBL6343068CHEMBL1713687BDTNHFVPZQIZFD-UHFFFAOYSA-NHMS2797L03
Database identifiers
- CAS
19541-96-9- PubChem CID
- 735132
- DTXSID
DTXSID00352738- ChEMBL
CHEMBL1713687- EC Number
- 830-225-7
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 56.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 173
Experimental & physicochemical properties
Solubility20.4 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Boiling point
- 363.5 · 363.5±27.0 °C(Predicted)
- Density
- 1.27 · 1.27±0.1 g/cm3(Predicted)
- pka
- 3.28 · 3.28±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
- HazardClass
- IRRITANT
- HS Code
- 2933399990 · 2933399990
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 1 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
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H335-H315-H319-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers9 total
苏州美石生物科技有限公司1173954148q · [email protected]
上海药禾平生物医药科技有限公司57540919 13120888836 · [email protected]
成都效佳科技有限公司15902830537 · [email protected]
常州探索化学有限公司15295164949 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
Changzhou Exploring Chemical Co., Ltd15295164949 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
Related reactions
20 records
Compound notes
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