2,6-Dimethyl-3-pyridylamine
Basic information
- CAS
3430-33-9- Standard SMILES
Cc1ccc(N)c(C)n1- InChIKey
WISXXOGOMDYNSN-UHFFFAOYSA-N- Molecular formula
- C7H10N2
- Average molar mass
- 122.17 g/mol
- Monoisotopic mass
- 122.08439833
Names & identifiers
- Preferred name
- 2,6-Dimethyl-3-pyridylamine
- IUPAC
- 2,6-dimethylpyridin-3-amine
- English name
- 3-Amino-2,6-dimethylpyridine
- Molecular formula
- C7H10N2
- Molecular weight
- 122.17
Names & synonyms
2,6-Dimethyl-3-pyridylamineEINECS 222-332-7DTXSID80187868NSC 100152RefChem:445665DTXCID40110359222-332-72,6-dimethylpyridin-3-amine3430-33-93-Amino-2,6-dimethylpyridine3-Amino-2,6-lutidineMFCD01646409
Show more names
-3-pyridyL2,6-DIMETHYL-3-PYRIDINAMINE2,6-diMethyl-3-pyridinylaMine2,6-Dimethyl-3-Amino Pyridine
2,6-dimethyl-3-aminopyridine3-Pyridinamine, 2,6-dimethyl-SCHEMBL3180972,6-Dimethyl-5-aminopyridine2,6-dimethylpyridin-3-ylamineZINC335270STK687224PS-6218
Database identifiers
- CAS
3430-33-9- PubChem CID
- 76964
- DTXSID
DTXSID80187868- ChEMBL
CHEMBL4539633- EC Number
- 222-332-7
- Nikkaji
- J79.796K
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 92.9
Physicochemical properties
- Melting point
- 121 · 121-123°C
- Boiling point
- 230 °C · 230°C
- Density
- 1.0289 · 1.0289 (estimate)
- refractive index
- 1.5663 · 1.5663 (estimate)
- Flash point
- 230 °C · 230°C
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- 7.61 · 7.61±0.10(Predicted)
- form
- powder
- color
- Yellow
- Water Solubility
- Insoluble in water.
- BRN
- 2424 · 2424
- InChI
- InChI=1S/C7H10N2/c1-5-3-4-7(8)6(2)9-5/h3-4H,8H2,1-2H3
- InChIKey
- WISXXOGOMDYNSN-UHFFFAOYSA-N
- SMILES
- C1(C)=NC(C)=CC=C1N
- CAS DataBase Reference
- 3430 · 3430-33-9(CAS DataBase Reference)
- Symbol(GHS)
- 6 · GHS06
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)
Aggregated GHS information provided per 5 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
- ridadr
- UN2811
- hs_code
- 2933399990
- risk_code
- 20/21/22-36/37/38-41-37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS06
- hazard_code
- Xi,Xn
- hazard_note
- Irritant
- safety_code
- 26-36/37/39-39
- hazard_class
- 6.1
- packing_group
- III
- Hazard statements
- H302-H312-H315-H319-H331-H335
- Limited Quantities
- 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Precautionary statements
- P261-P280-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
Uses3-Amino-2,6-dimethylpyridine is used as pharmaceutical intermediate.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
13 records
Compound notes
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