4-chloro-N-(2-iodophenyl)benzamide
Basic information
- CAS
346689-44-9- Standard SMILES
O=C(Nc1ccccc1I)c1ccc(Cl)cc1- InChIKey
HBDDEFUTPBIDLH-UHFFFAOYSA-N- Molecular formula
- C13H9ClINO
- Average molar mass
- 357.57 g/mol
- Monoisotopic mass
- 356.94174
Names & identifiers
- Preferred name
- 4-chloro-N-(2-iodophenyl)benzamide
- IUPAC
- 4-chloro-N-(2-iodophenyl)benzamide
- English name
- 4-Chloro-N-(2-iodophenyl)benzaMide, 97%
- Molecular formula
- C13H9ClINO
- Molecular weight
- 357.57
Names & synonyms
4-chloro-N-(2-iodophenyl)benzamide346689-44-9Cambridge id 5346038STK039013AKOS001185148ST50682603(4-chlorophenyl)-N-(2-iodophenyl)carboxamideAB00081773-01SR-01000205985SR-01000205985-1Z28163865Benzamide, 4-chloro-N-(2-iodophenyl)-
Show more names
4-Chloro-N-(2-iodophenyl)benzamide,97%4-Chloro-N-(2-iodophenyl)benzaMide, 97%
Database identifiers
- CAS
346689-44-9- PubChem CID
- 984589
- EC Number
- 163-595-7
Properties
Computed structural properties
- XLogP
- 3.8
- 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
- Melting point
- 150 · 150-151 °C
- Boiling point
- 346.1 · 346.1±27.0 °C(Predicted)
- Density
- 1.767 · 1.767±0.06 g/cm3(Predicted)
- pka
- 12.36 · 12.36±0.70(Predicted)
- Sensitive
- Light Sensitive
- Symbol(GHS)
- 7 · GHS07
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P351+P338, P337+P317, P391, 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 CategoriesEye Irrit. 2 (100%)
Safety data
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
UsesStructural diversity in the aryl moiety (benzamides, heteroarylamides, arylimides) had a major influence on (sub)nanomolar D3receptor affinity.
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Related reactions
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Compound notes
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