8009-9300 Screening compound: 5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Chemical Structure Depiction of ChemDiv screening compound 8009-9300
5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]decane
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
8009-9300
Molecular Formula
C8H12N4O4 (C8 H12 N4 O4)
Compound Name
5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]decane
IUPAC name
57-dinitro-13-diazatricyclo[3.3.1.1^{37}]decane
SMILES
[O-][N+](C(C1)(C2)CN(C3)CN2CC13[N+]([O-])=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
228.21
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
-0.157
Distribution Coefficient, logD
-0.158
Water Solubility, LogSw
-0.16
Polar Surface Area
73.317
Acid Dissociation Constant (pKa)
29.70
Base Dissociation Constant (pKb)
4.76
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
100.00
References: we are preparing a list of scientific research reports with 8009-9300 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)