Basic information
- CAS
36845-08-6- Standard SMILES
Cc1cccc(NC(=O)c2ccc(N)cc2)n1- InChIKey
OJJAQNZSNFIQSA-UHFFFAOYSA-N- Molecular formula
- C13H13N3O
- Average molar mass
- 227.26 g/mol
- Monoisotopic mass
- 227.10586205
Names & identifiers
- Preferred name
- Benzamide, p-amino-N-(6-methyl-2-pyridyl)-
- IUPAC
- 4-amino-N-(6-methyl-2-pyridinyl)benzamide
- English name
- N-(6-Methyl-2-pyridyl)-4-aminobenzamide
- Molecular formula
- C13H13N3O
- Molecular weight
- 227.26
Names & synonyms
4-amino-N-(6-methylpyridin-2-yl)benzamide36845-08-6BENZAMIDE, p-AMINO-N-(6-METHYL-2-PYRIDYL)-6-(p-Aminobenzamido)-2-picolineBRN 04015112-Picoline, 6-(p-aminobenzamido)-Pyridine, 2-(p-aminobenzamido)-6-methyl-DTXSID401903185-22-09-00222 (Beilstein Handbook Reference)RefChem:561608DTXCID50112809869-134-2
Show more names
Benzamide, 4-amino-N-(6-methyl-2-pyridinyl)-
N-(6-Methyl-2-pyridyl)-4-aminobenzamideBAS 008754884-Amino-N-(6-methyl-2-pyridyl)benzamideEBC-46232AKOS0002048264-amino-N-(6-methyl-2-pyridinyl)benzamideCS-0232600G49938
Database identifiers
- CAS
36845-08-6- PubChem CID
- 37553
- DTXSID
DTXSID40190318- EC Number
- 869-134-2
- Nikkaji
- J54.648H
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
Physicochemical properties
- Melting point
- 128 °C · 128 °C
- Boiling point
- 345.4 · 345.4±37.0 °C(Predicted)
- Density
- 1.261 · 1.261±0.06 g/cm3(Predicted)
- pka
- 13.05 · 13.05±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H302-H315
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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)
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
- H335-H319-H302-H315
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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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