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PRE-084

CAT: 1410-M17272-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1410-M17272-03Size:10 mg
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Description
PRE-084 hydrochloride is a high affinity, selective σ1 agonist.
CAS Number
138847-85-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
353.88
Molecular Formula
C19H28ClNO3
Notes
Research use only, not for human use.
Receptor
Σ1

Chemical Information

2-(4-Morpholinyl)ethyl 1-phenylcyclohexanecarboxylate

1-phenyl-1-cyclohexanecarboxylic acid 2-(4-morpholinyl)ethyl ester is a member of morpholines.

CAS Number138847-85-5
PubChem CID126402
IUPAC Name2-morpholin-4-ylethyl 1-phenylcyclohexane-1-carboxylate
Molecular FormulaC19H27NO3
Molecular Weight317.4
XLogP3.3
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count23
Formal Charge0
Complexity367
SMILES
C1CCC(CC1)(C2=CC=CC=C2)C(=O)OCCN3CCOCC3
InChI
InChI=1S/C19H27NO3/c21-18(23-16-13-20-11-14-22-15-12-20)19(9-5-2-6-10-19)17-7-3-1-4-8-17/h1,3-4,7-8H,2,5-6,9-16H2
InChIKey
RQHKZUBCUZVZEF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-Morpholinyl)ethyl 1-phenylcyclohexanecarboxylate
CAS: 138847-85-5
CID: 126402
Formula: C19H27NO3
MW: 317.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight317.4
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass317.19909372
Monoisotopic Mass317.19909372
Topological Polar Surface Area38.8 Ų
Heavy Atom Count23
Formal Charge0
Complexity367
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
C8549-100PRE-084
B6364-10PRE-084 hydrochloride
HY-18100A-01PRE-084 (hydrochloride)
531268PRE-084 HCl
HY-18100AR-01PRE-084 (hydrochloride) (Standard)

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