Basic information
- CAS
23600-46-6- Standard SMILES
Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1- InChIKey
CYSQNIFSCOEHDN-UHFFFAOYSA-N- Molecular formula
- C13H11ClN2O
- Average molar mass
- 246.69 g/mol
- Monoisotopic mass
- 246.0559907
Names & identifiers
- Preferred name
- N-(4-Aminophenyl)-4-chlorobenzamide
- IUPAC
- N-(4-aminophenyl)-4-chlorobenzamide
- English name
- N-(4-Aminophenyl)-4-chlorobenzamide
- Molecular formula
- C13H11ClN2O
- Molecular weight
- 246.69
Names & synonyms
N-(4-Aminophenyl)-4-chlorobenzamide23600-46-6DTXSID60359364RefChem:361734DTXCID40310418Oprea1_668980SCHEMBL678618CHEMBL260467CYSQNIFSCOEHDN-UHFFFAOYSA-NYAA60046AKOS000131874EBC-551083
Show more names
AKOS BBV-012898OTAVA-BB 1166859Benzamide, N-(4-aminophenyl)-4-chloro-
N-(4-Aminophenyl)-4-chloro-benzamideDA-07849ST51039276EN300-53755N-(4-aminophenyl)(4-chlorophenyl)carboxamideG32307benzenecarboxamide, N-(4-aminophenyl)-4-chloro-Z57442200
Database identifiers
- CAS
23600-46-6- PubChem CID
- 960654
- DTXSID
DTXSID60359364- ChEMBL
CHEMBL260467- EC Number
- 127-483-1
- Nikkaji
- J2.880.668J
Properties
Computed structural properties
- XLogP
- 2.6
- 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
- 256
Physicochemical properties
- Boiling point
- 348.6 · 348.6±27.0 °C(Predicted)
- Density
- 1.351 · 1.351±0.06 g/cm3(Predicted)
- pka
- 12.77 · 12.77±0.70(Predicted)
- 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.
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, P317, 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_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers5 total
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
菏泽书颖生物科技有限公司18553078733 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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