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MTEP hydrochloride 10mg

CAT: 0628-A15174-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A15174-10Size:10 mg
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CAS Number
1186195-60-7

Chemical Information

MTEP hydrochloride
CAS Number1186195-60-7
PubChem CID45073467
IUPAC Name2-methyl-4-(2-pyridin-3-ylethynyl)-1,3-thiazole;hydrochloride
Molecular FormulaC11H9ClN2S
Molecular Weight236.72
Topological Polar Surface Area54
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity253
SMILES
CC1=NC(=CS1)C#CC2=CN=CC=C2.Cl
InChI
InChI=1S/C11H8N2S.ClH/c1-9-13-11(8-14-9)5-4-10-3-2-6-12-7-10;/h2-3,6-8H,1H3;1H
InChIKey
YCIOJDKGCWAHLR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of MTEP hydrochloride
CAS: 1186195-60-7
CID: 45073467
Formula: C11H9ClN2S
MW: 236.72
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight236.72
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass236.0174972
Monoisotopic Mass236.0174972
Topological Polar Surface Area54 Ų
Heavy Atom Count15
Formal Charge0
Complexity253
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes