Basic information
- CAS
425651-25-8- Standard SMILES
Cc1cccc(C(=O)Nc2ccc(N)cc2)c1- InChIKey
HZZTVMGUTMBMPG-UHFFFAOYSA-N- Molecular formula
- C14H14N2O
- Average molar mass
- 226.27 g/mol
- Monoisotopic mass
- 226.11061307
Names & identifiers
- Preferred name
- N-(4-aminophenyl)-3-methylbenzamide
- IUPAC
- N-(4-aminophenyl)-3-methylbenzamide
- English name
- N-(4-Aminophenyl)-3-methylbenzamide
- Molecular formula
- C14H14N2O
- Molecular weight
- 226.27
Names & synonyms
N-(4-aminophenyl)-3-methylbenzamide425651-25-8MFCD01806271N-(4-Aminophenyl)-3-methyl-benzamideN-(4-aminophenyl)(3-methylphenyl)carboxamideASISCHEM T31121Oprea1_541927SCHEMBL677855AKOS BB-8156SCHEMBL5133271AKOS BBV-006404DTXSID00352975
Show more names
Benzamide, N-(4-aminophenyl)-3-methyl-
HZZTVMGUTMBMPG-UHFFFAOYSA-NART-CHEM-BB B025202ASA65125BBL023384LABOTEST-BB LT00517649SBB023084STK347412OTAVA-BB S000022362
Database identifiers
- CAS
425651-25-8- PubChem CID
- 736248
- DTXSID
DTXSID00352975
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Boiling point
- 337.9 · 337.9±35.0 °C(Predicted)
- Density
- 1.21 · 1.210±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 13 · 13+-.0.70(Predicted)
- Appearance
- Light yellow to light brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers9 total
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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