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Compound FL0240

CAT: 0931-FL0240-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-FL0240-02Size:25 mg
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CAS Number
889944-57-4
Bioactivity
Compound FL0240, with CAS No. 889944-57-4, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound FL0240 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.
Smiles
OC(=O)C1CC2(C1)CC(=O)C2
Molecular Formula
C8H10O3
Molecular Weight
154.16
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

6-Oxospiro[3.3]heptane-2-carboxylic acid
CAS Number889944-57-4
PubChem CID33695230
IUPAC Name2-oxospiro[3.3]heptane-6-carboxylic acid
Molecular FormulaC8H10O3
Molecular Weight154.16
XLogP-0.2
Topological Polar Surface Area54.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity215
SMILES
C1C(CC12CC(=O)C2)C(=O)O
InChI
InChI=1S/C8H10O3/c9-6-3-8(4-6)1-5(2-8)7(10)11/h5H,1-4H2,(H,10,11)
InChIKey
FGDRQRQOJRZARK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-Oxospiro[3.3]heptane-2-carboxylic acid
CAS: 889944-57-4
CID: 33695230
Formula: C8H10O3
MW: 154.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight154.16
XLogP3-0.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass154.062994177
Monoisotopic Mass154.062994177
Topological Polar Surface Area54.4 Ų
Heavy Atom Count11
Formal Charge0
Complexity215
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

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FL0200-01Compound FL0200
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