Basic information
- CAS
62135-67-5- Standard SMILES
Cc1ccc(C(=O)Nc2cccc(C)n2)cc1- InChIKey
KKJDKPDTFKUTOX-UHFFFAOYSA-N- Molecular formula
- C14H14N2O
- Average molar mass
- 226.27 g/mol
- Monoisotopic mass
- 226.11061307
Names & identifiers
- Preferred name
- Benzamide, 4-methyl-N-(6-methyl-2-pyridinyl)-
- IUPAC
- 4-methyl-N-(6-methyl-2-pyridinyl)benzamide
- English name
- Benzamide, 4-methyl-N-(6-methyl-2-pyridinyl)-
- Molecular formula
- C14H14N2O
- Molecular weight
- 226.27
Names & synonyms
4-methyl-N-(6-methylpyridin-2-yl)benzamideBenzamide, 4-methyl-N-(6-methyl-2-pyridinyl)-62135-67-5Oprea1_057044Oprea1_546142SCHEMBL23367929DTXSID70398562AKOS0037450464-methyl-N-(6-methyl-2-pyridinyl)benzamideST45140686N-(6-methyl(2-pyridyl))(4-methylphenyl)carboxamideZ71545274
Show more names
4-METHYL-N-(6-METHYL-PYRIDIN-2-YL)-BENZAMIDE
Database identifiers
- CAS
62135-67-5- PubChem CID
- 4017136
- DTXSID
DTXSID70398562- EC Number
- 141-310-7
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Melting point
- 118 · 118-120 °C(Solv: benzene (71-43-2); hexane (110-54-3))
- Boiling point
- 302.2 · 302.2±37.0 °C(Predicted)
- Density
- 1.165 · 1.165±0.06 g/cm3(Predicted)
- pka
- 12.46 · 12.46±0.70(Predicted)
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]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, 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%)
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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