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Compound FL0133

CAT: 0013-GTR19269720-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19269720-02Size:5 mg
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Description
Compound FL0133, with CAS No. 133427-10-8, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound FL0133 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
133427-10-8
Purity
96.16% (May vary between batches)
Smiles
Cc1cn2cccc (C (O) =O) c2n1
Molecular Formula
C9H8N2O2
Molecular Weight
176.172
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Methylimidazo[1,2-a]pyridine-8-carboxylic acid
CAS Number133427-10-8
PubChem CID18983804
IUPAC Name2-methylimidazo[1,2-a]pyridine-8-carboxylic acid
Molecular FormulaC9H8N2O2
Molecular Weight176.17
XLogP1.7
Topological Polar Surface Area54.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity220
SMILES
CC1=CN2C=CC=C(C2=N1)C(=O)O
InChI
InChI=1S/C9H8N2O2/c1-6-5-11-4-2-3-7(9(12)13)8(11)10-6/h2-5H,1H3,(H,12,13)
InChIKey
ADVZTFKLJNMYJE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methylimidazo[1,2-a]pyridine-8-carboxylic acid
CAS: 133427-10-8
CID: 18983804
Formula: C9H8N2O2
MW: 176.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight176.17
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass176.058577502
Monoisotopic Mass176.058577502
Topological Polar Surface Area54.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity220
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
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GTR19269721-01Compound FL0134
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GTR19269729-01Compound FL0163
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GTR19269743-01Compound FL0193
GTR19269741-01Compound FL0188
GTR19269739-01Compound FL0180

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