Y501-6086 Screening compound: ethyl 2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)acetate
Chemical Structure Depiction of ChemDiv screening compound Y501-6086
ethyl 2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)acetate
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
Y501-6086
Molecular Formula
C8H10N4O6 (C8 H10 N4 O6)
Compound Name
ethyl 2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)acetate
IUPAC name
ethyl 2-(5-methyl-34-dinitro-1H-pyrazol-1-yl)acetate
SMILES
CCOC(Cn(c(C)c1[N+]([O-])=O)nc1[N+]([O-])=O)=O
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
258.19
Hydrogen Bond Acceptors Count
12.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
0.571
Distribution Coefficient, logD
0.571
Water Solubility, LogSw
-0.42
Polar Surface Area
100.468
Acid Dissociation Constant (pKa)
24.83
Base Dissociation Constant (pKb)
-4.70
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
50.00
References: we are preparing a list of scientific research reports with Y501-6086 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)