Basic information
- CAS
102630-86-4- Standard SMILES
Cc1cccc(NC(=O)c2cccc(N)c2)c1C- InChIKey
SSGORUYGVLRARA-UHFFFAOYSA-N- Molecular formula
- C15H16N2O
- Average molar mass
- 240.3 g/mol
- Monoisotopic mass
- 240.12626314
Names & identifiers
- Preferred name
- 3-amino-N-(2,3-dimethylphenyl)benzamide
- IUPAC
- 3-amino-N-(2,3-dimethylphenyl)benzamide
- English name
- 3-AMINO-N-(2,3-DIMETHYLPHENYL)BENZAMIDE
- Molecular formula
- C15H16N2O
- Molecular weight
- 240.3
Names & synonyms
3-amino-N-(2,3-dimethylphenyl)benzamide102630-86-4MFCD03070710Benzamide, 3-amino-N-(2,3-dimethylphenyl)-(3-aminophenyl)-N-(2,3-dimethylphenyl)carboxamideCambridge id 7073988CHEMBL37026SCHEMBL7996943DTXSID00424186SSGORUYGVLRARA-UHFFFAOYSA-NALBB-025669BBL002642
Show more names
OTAVA-BB 1056945CBI-BB ZERO/006492UKRORGSYN-BB BBV-0239923-amino-N-(2,3-dimethylphenyl)benzamide(SALTDATA: FREE)
SBB018416STK519624AKOS000139876DA-16187VS-01140ST4142780CS-0313760H35243
Database identifiers
- CAS
102630-86-4- PubChem CID
- 6456586
- DTXSID
DTXSID00424186- ChEMBL
CHEMBL37026- Nikkaji
- J1.365.585E
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 292
Physicochemical properties
- Melting point
- 174 · 174-175 °C(Solv: benzene (71-43-2))
- Boiling point
- 351.1 · 351.1±42.0 °C(Predicted)
- Density
- 1.182 · 1.182±0.06 g/cm3(Predicted)
- pka
- 13.71 · 13.71±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers4 total
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
3 records
Compound notes
Loading…