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Phaclofen

CAT: 0013-GTR19201007-05Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19201007-05Size:50 mg
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Description
Phaclofen is a selective GABAB receptor antagonist used in neuroscience research. It reverses the inhibitory effects of baclofen and GABA on cholinergic contractions in isolated guinea pig ileum and colon preparations, making it a valuable tool for studying GABAergic signaling in vitro.
CAS Number
114012-12-3
Product Name Alternative
3-Amino-2- (4-chlorophenyl) propanephosphonic acid, GABA Receptor, GABAReceptor, Phaclofen
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Purity
99.32% (May vary between batches)
Solubility
1eq. NaOH:<6.24 mg/mL; H2O:30 mg/mL (120.18 mM) ; DMSO:< 1 mg/mL (23.90 mM)
Smiles
O=P (O) (O) CC (C1=CC=C (Cl) C=C1) CN
Molecular Formula
C9H13ClNO3P
Molecular Weight
249.63
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Phaclofen

peripheral & central baclofen & GABA antagonist; structure given in first source

CAS Number114012-12-3
PubChem CID1641
IUPAC Name[3-amino-2-(4-chlorophenyl)propyl]phosphonic acid
Molecular FormulaC9H13ClNO3P
Molecular Weight249.63
XLogP-2.4
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity238
SMILES
C1=CC(=CC=C1C(CN)CP(=O)(O)O)Cl
InChI
InChI=1S/C9H13ClNO3P/c10-9-3-1-7(2-4-9)8(5-11)6-15(12,13)14/h1-4,8H,5-6,11H2,(H2,12,13,14)
InChIKey
VSGNGLJPOGUDON-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Phaclofen
CAS: 114012-12-3
CID: 1641
Formula: C9H13ClNO3P
MW: 249.63
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight249.63
XLogP3-2.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass249.0321580
Monoisotopic Mass249.0321580
Topological Polar Surface Area83.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity238
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

Alternative Products

CatalogName
HY-100798-01Phaclofen

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