8020-6749 Screening compound: trimethyl 1,2,3-tricyano-1,2,3-cyclopropanetricarboxylate
Chemical Structure Depiction of ChemDiv screening compound 8020-6749
trimethyl 1,2,3-tricyano-1,2,3-cyclopropanetricarboxylate
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
8020-6749
Molecular Formula
C12H9N3O6 (C12 H9 N3 O6)
Compound Name
trimethyl 1,2,3-tricyano-1,2,3-cyclopropanetricarboxylate
IUPAC name
n/a
SMILES
COC(C(C1(C(OC)=O)C#N)(C1(C(OC)=O)C#N)C#N)=O
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
291.22
Hydrogen Bond Acceptors Count
12.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
0.343
Distribution Coefficient, logD
0.343
Water Solubility, LogSw
0.14
Polar Surface Area
115.452
Acid Dissociation Constant (pKa)
35.48
Base Dissociation Constant (pKb)
-4.35
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
50.00
References: we are preparing a list of scientific research reports with 8020-6749 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)