R052-2059 Screening compound: pentafluoroaniline
Chemical Structure Depiction of ChemDiv screening compound R052-2059
pentafluoroaniline
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
R052-2059
Molecular Formula
C6H2F5N (C6 H2 F5 N)
Compound Name
pentafluoroaniline
IUPAC name
pentafluoroaniline
SMILES
Nc(c(F)c(c(F)c1F)F)c1F
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
183.08
Hydrogen Bond Acceptors Count
0.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
0.00
Number of Nitrogen and Oxygen Atoms
1
Partition Coefficient, logP
2.325
Distribution Coefficient, logD
2.325
Water Solubility, LogSw
-1.95
Polar Surface Area
19.625
Acid Dissociation Constant (pKa)
13.08
Base Dissociation Constant (pKb)
-0.69
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
0.00
R052-2059 in Drug Discovery
Included in Screening Libraries
Human Receptors Annotated Library (5376 compounds)
Human Transcription Factors Annotated Library (5098 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with R052-2059 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)