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Lorbamate

CAT: 0013-GTR19193706-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19193706-02Size:50 mg
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Description
Carbamate is a small molecule compound investigated for its sedative and muscle relaxant properties. It serves as a research tool in pharmacological studies, including in vitro receptor binding assays and in vivo models of muscle activity and sedation.
CAS Number
24353-88-6
Smiles
C (COC (NC1CC1) =O) (COC (N) =O) (CCC) C
Molecular Formula
C12H22N2O4
Molecular Weight
258.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Lorbamate
CAS Number24353-88-6
PubChem CID32322
IUPAC Name[2-(carbamoyloxymethyl)-2-methylpentyl] N-cyclopropylcarbamate
Molecular FormulaC12H22N2O4
Molecular Weight258.31
XLogP1.7
Topological Polar Surface Area90.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Heavy Atom Count18
Formal Charge0
Complexity304
SMILES
CCCC(C)(COC(=O)N)COC(=O)NC1CC1
InChI
InChI=1S/C12H22N2O4/c1-3-6-12(2,7-17-10(13)15)8-18-11(16)14-9-4-5-9/h9H,3-8H2,1-2H3,(H2,13,15)(H,14,16)
InChIKey
PTEUWWFEEPASRM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lorbamate
CAS: 24353-88-6
CID: 32322
Formula: C12H22N2O4
MW: 258.31
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight258.31
XLogP31.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass258.15795719
Monoisotopic Mass258.15795719
Topological Polar Surface Area90.7 Ų
Heavy Atom Count18
Formal Charge0
Complexity304
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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