5-Bromo-3,4-dimethylpyridin-2-amine
Basic information
- CAS
374537-97-0- Standard SMILES
Cc1c(Br)cnc(N)c1C- InChIKey
YAVKJNIMFGZBSY-UHFFFAOYSA-N- Molecular formula
- C7H9BrN2
- Average molar mass
- 201.06 g/mol
- Monoisotopic mass
- 199.99491
Names & identifiers
- Preferred name
- 5-Bromo-3,4-dimethylpyridin-2-amine
- IUPAC
- 5-bromo-3,4-dimethylpyridin-2-amine
- English name
- 2-Amino-5-bromo-3,4-dimethylpyridine
- Molecular formula
- C7H9BrN2
- Molecular weight
- 201.06
Names & synonyms
374537-97-05-Bromo-3,4-dimethylpyridin-2-amineDTXSID90426619RefChem:533405DTXCID70377453678-700-62-AMINO-5-BROMO-3,4-DIMETHYLPYRIDINEMFCD020939475-bromo-3,4-dimethyl-pyridin-2-amine5-bromo-3,4-dimethyl-pyridin-2-ylamineSCHEMBL1181354AKOS016007550
Show more names
SKL2495-Bromo-3,4-dimethyl-2-pyridinamine2-Amino-3,4-dimethyl-5-bromopyridine2-Pyridinamine, 5-bromo-3,4-dimethyl-2-AMINO-5-BROMO-3,4-DIMETHYLPYRIDINE 97%2-AMINO-5-BROMO-3,4-DIMETHYLPYRIDINE ISO 9001：2015 REACH
CS-W015564FD10625SB78225DS-15137AMY183995-bromo-3,4-dimethyl-2-pyridylamineSY238395DB-069537
Database identifiers
- CAS
374537-97-0- PubChem CID
- 7010307
- DTXSID
DTXSID90426619- EC Number
- 678-700-6
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 118
Physicochemical properties
- Melting point
- 133 · 133-135°C
- Boiling point
- 278.2 · 278.2±35.0 °C(Predicted)
- Density
- 1.504 · 1.504±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- 5.59 · 5.59±0.50(Predicted)
- Appearance
- Light yellow to brown Solid
- Water Solubility
- Insoluble in water.
- InChI
- InChI=1S/C7H9BrN2/c1-4-5(2)7(9)10-3-6(4)8/h3H,1-2H3,(H2,9,10)
- InChIKey
- YAVKJNIMFGZBSY-UHFFFAOYSA-N
- SMILES
- C1(N)=NC=C(Br)C(C)=C1C
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H315-H319-H331-H335
- Precautionary statements
- 261 · P261-P280-P304+P340-P305+P351+P338-P405-P501a
- Hazard Codes
- Xn
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
- risk_code
- 20/21/22-36/37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS06
- hazard_code
- Xn
- safety_code
- 26-36/37/39
- hazard_class
- 6.1
- packing_group
- III
- Hazard statements
- H302-H312-H315-H319-H331-H335
- Precautionary statements
- P261-P280-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
UsesIt is an active pharmaceutical ingredient.
Related reactions
9 records
Compound notes
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