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EEDQ

CAT: 0013-GTR19208625-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19208625-03Size:100 mg
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Description
EEDQ is an irreversible dopamine receptor antagonist and a carboxyl-specific coupling reagent. It facilitates high-yield, racemization-free peptide synthesis between acylamino acids and amino acid esters. This compound is used in neuroscience and peptide chemistry research for both in vitro biochemical assays and in vivo receptor inactivation studies.
CAS Number
16357-59-8
Smiles
CCOC1C=Cc2ccccc2N1C (=O) OCC
Molecular Formula
C14H17NO3
Molecular Weight
247.29
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Ethoxy-1-(ethoxycarbonyl)-1,2-dihydroquinoline

peptide coupling reagent

CAS Number16357-59-8
PubChem CID27833
IUPAC Nameethyl 2-ethoxy-2H-quinoline-1-carboxylate
Molecular FormulaC14H17NO3
Molecular Weight247.29
XLogP2.8
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity316
SMILES
CCOC1C=CC2=CC=CC=C2N1C(=O)OCC
InChI
InChI=1S/C14H17NO3/c1-3-17-13-10-9-11-7-5-6-8-12(11)15(13)14(16)18-4-2/h5-10,13H,3-4H2,1-2H3
InChIKey
GKQLYSROISKDLL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Ethoxy-1-(ethoxycarbonyl)-1,2-dihydroquinoline
CAS: 16357-59-8
CID: 27833
Formula: C14H17NO3
MW: 247.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight247.29
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass247.12084340
Monoisotopic Mass247.12084340
Topological Polar Surface Area38.8 Ų
Heavy Atom Count18
Formal Charge0
Complexity316
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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HY-Y1191-01EEDQ
62813-01EEDQ extrapure, 99%
16764018-100gEEDQ (2-Ethoxy-1-ethoxycarbonyl-1,2-dihydroquinoline)

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