N-(3,4-Difluorophenyl)-2-(4-(2-fluorophenyl)-1-piperazinyl)acetamide
Basic information
- CAS
303091-72-7- Standard SMILES
O=C(CN1CCN(c2ccccc2F)CC1)Nc1ccc(F)c(F)c1- InChIKey
YZBLPDKTIKBFDS-UHFFFAOYSA-N- Molecular formula
- C18H18F3N3O
- Average molar mass
- 349.3 g/mol
- Monoisotopic mass
- 349.14019669
Names & identifiers
- Preferred name
- N-(3,4-Difluorophenyl)-2-(4-(2-fluorophenyl)-1-piperazinyl)acetamide
- IUPAC
- N-(3,4-difluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide
- English name
- N-(3,4-Difluorophenyl)-2-[4-(2-fluorophenyl)piperazino]acetamide
- Molecular formula
- C18H18F3N3O
- Molecular weight
- 349.35
Names & synonyms
303091-72-7N-(3,4-DIFLUOROPHENYL)-2-(4-(2-FLUOROPHENYL)-1-PIPERAZINYL)ACETAMIDERefChem:825825652-990-4N-(3,4-difluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamideN-(3,4-Difluorophenyl)-2-(4-(2-fluorophenyl)piperazin-1-yl)acetamideN-(3,4-difluorophenyl)-2-[4-(2-fluorophenyl)piperazino]acetamideSTK283096AKOS001317696JS-1857CS-0333257Z30970144
Show more names
1-Piperazineacetamide, N-(3,4-difluorophenyl)-4-(2-fluorophenyl)-
Database identifiers
- CAS
303091-72-7- PubChem CID
- 853055
- EC Number
- 652-990-4
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 35.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 445
Physicochemical properties
- Boiling point
- 496.6 · 496.6±45.0 °C(Predicted)
- Density
- 1.323 · 1.323±0.06 g/cm3(Predicted)
- pka
- 12.8 · 12.80±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 319 · H319-H400-H315-H335
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P273-P391-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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H319-H400-H315-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P273-P391-P501
Suppliers
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Related reactions
0 records
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Compound notes
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