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(±) Epibatidine

CAT: 1106-BML-C114-0005Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1106-BML-C114-0005Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
140111-52-0
Certification
RUO
Target
Acetylcholine receptor
Type
Ligand
Stability
As indicated on product label or CoA when stored as recommended.
Purity
≥99% (HPLC)
Solubility
Soluble in water (5 mg/ml) or DMSO (20 mg/ml) .
Molecular Formula
C 11 H 13 ClN 2
Molecular Weight
208.7
Shipping Conditions
Ambient Temperature
Storage Conditions
-20°C
Appearance
White solid.

Chemical Information

Epibatidine

epibatidine has been reported in Epipedobates anthonyi with data available.

CAS Number140111-52-0
PubChem CID854023
IUPAC Name(1R,2R,4S)-2-(6-chloro-3-pyridinyl)-7-azabicyclo[2.2.1]heptane
Molecular FormulaC11H13ClN2
Molecular Weight208.69
XLogP2.2
Topological Polar Surface Area24.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity221
SMILES
C1C[C@@H]2[C@H](C[C@H]1N2)C3=CN=C(C=C3)Cl
InChI
InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2/t8-,9+,10+/m0/s1
InChIKey
NLPRAJRHRHZCQQ-IVZWLZJFSA-N
Chemical Structure
2D Structure
2D structure of Epibatidine
CAS: 140111-52-0
CID: 854023
Formula: C11H13ClN2
MW: 208.69
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight208.69
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass208.0767261
Monoisotopic Mass208.0767261
Topological Polar Surface Area24.9 Ų
Heavy Atom Count14
Formal Charge0
Complexity221
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-169742Epibatidine
T13468-01(±)-Epibatidine
HY-101078-01(±) -Epibatidine
MBS5767919-01(+/-)-Epibatidine
448308-01(-) -Epibatidine
TRC-E582205-75MG(+)-Epibatidine
448307(+) -Epibatidine
TRC-E582210-75MG(-)-Epibatidine
MGA88501-01(±) -Epibatidine dihydrochloride
MBS5775110Epibatidine 2HCl

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