N-Cyclohexyl-2,4-dichlorobenzamide
Basic information
- CAS
157729-57-2- Standard SMILES
O=C(NC1CCCCC1)c1ccc(Cl)cc1Cl- InChIKey
FMFXAPQQVBRACZ-UHFFFAOYSA-N- Molecular formula
- C13H15Cl2NO
- Average molar mass
- 272.17 g/mol
- Monoisotopic mass
- 271.0530695
Names & identifiers
- Preferred name
- N-Cyclohexyl-2,4-dichlorobenzamide
- IUPAC
- 2,4-dichloro-N-cyclohexylbenzamide
- English name
- 2,4-dichloro-N-cyclohexylbenzamide
- Molecular formula
- C13H15Cl2NO
- Molecular weight
- 272.17
Names & synonyms
N-Cyclohexyl-2,4-dichlorobenzamideRefChem:829540662-544-02,4-dichloro-N-cyclohexylbenzamide157729-57-2NSC6907Oprea1_266367Oprea1_607893DTXSID60278283NSC-6907MFCD00157752STK030884
Show more names
Benzamide, 2,4-dichloro-N-cyclohexyl-
AKOS000489987ST024288(2,4-dichlorophenyl)-N-cyclohexylcarboxamideAG-205/03640054Z31484280
Database identifiers
- CAS
157729-57-2- PubChem CID
- 221833
- DTXSID
DTXSID60278283- EC Number
- 662-544-0
- Nikkaji
- J1.775.916G
Properties
Computed structural properties
- XLogP
- 4.3
- 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
- 266
Physicochemical properties
- Boiling point
- 390.8 · 390.8±32.0 °C(Predicted)
- Density
- 1.27 · 1.27±0.1 g/cm3(Predicted)
- pka
- 13.2 · 13.20±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318-H335-H302-H413-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H318-H335-H302-H413-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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