8018-8654 Screening compound: octahydro-2H-1,4-benzoxazine
Chemical Structure Depiction of ChemDiv screening compound 8018-8654
octahydro-2H-1,4-benzoxazine
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
8018-8654
Molecular Formula
C8H15NO (C8 H15 NO)
Compound Name
octahydro-2H-1,4-benzoxazine
IUPAC name
octahydro-2H-14-benzoxazine
SMILES
C1CC2NCCOC2CC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
HBr
Molecular Weight
141.21
Hydrogen Bond Acceptors Count
2.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
0.00
Number of Nitrogen and Oxygen Atoms
2
Partition Coefficient, logP
0.747
Distribution Coefficient, logD
-0.186
Water Solubility, LogSw
-0.11
Polar Surface Area
20.778
Acid Dissociation Constant (pKa)
27.17
Base Dissociation Constant (pKb)
8.28
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
100.00
References: we are preparing a list of scientific research reports with 8018-8654 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)