Basic information
- CAS
18109-39-2- Standard SMILES
Cc1cccc(C)c1NC(=O)c1ccccc1- InChIKey
QGUFWIMSJMAPET-UHFFFAOYSA-N- Molecular formula
- C15H15NO
- Average molar mass
- 225.28 g/mol
- Monoisotopic mass
- 225.1153641
Names & identifiers
- Preferred name
- N-(2,6-Dimethylphenyl)benzamide
- IUPAC
- N-(2,6-dimethylphenyl)benzamide
- English name
- TIMTEC-BB SBB005915
- Molecular formula
- C15H15NO
- Molecular weight
- 225.29
Names & synonyms
N-(2,6-Dimethylphenyl)benzamide18109-39-2Benzamide, N-(2,6-dimethylphenyl)-DTXSID20171069RefChem:1090896DTXCID40935602',6'-BenzoxylidideBRN 2110040AI3-03671NSC4065382',6'-Dimethylbenzanilide0-12-00-01109 (Beilstein Handbook Reference)
Show more names
TIMTEC-BB SBB005915N-(2,6-DIMETHYLPHENYL)-BENZAMIDE
SCHEMBL4138460SCHEMBL6544767AKOS001303040AS-0321NSC 406538NSC-406538ST013690CS-0336744
Database identifiers
- CAS
18109-39-2- PubChem CID
- 101321
- DTXSID
DTXSID20171069- Nikkaji
- J603.590F
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- Melting point
- 168 · 168-169 °C
- Boiling point
- 274.8 · 274.8±29.0 °C(Predicted)
- Density
- 1.121 · 1.121±0.06 g/cm3(Predicted)
- pka
- 13.53 · 13.53±0.70(Predicted)
- EWG's Food Scores
- 1 · 1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Suppliers6 total
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
武汉泰凯塞科技有限公司027-86697669 13986148687 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
湖北创联康成药物化学有限公司027-65388397 18164111589 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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