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Compound FL0232

CAT: 0013-GTR19269760-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19269760-01Size:10 mg
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Description
Compound FL0232, with CAS No. 1363381-18-3, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound FL0232 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
1363381-18-3
Purity
99.74% (May vary between batches)
Smiles
CC (C) (C) OC (=O) N1CC2 (C1) CCC (CC2) C (O) =O
Molecular Formula
C14H23NO4
Molecular Weight
269.34
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-(Tert-butoxycarbonyl)-2-azaspiro[3.5]nonane-7-carboxylic acid
CAS Number1363381-18-3
PubChem CID72207287
IUPAC Name2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azaspiro[3.5]nonane-7-carboxylic acid
Molecular FormulaC14H23NO4
Molecular Weight269.34
XLogP1.7
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count19
Formal Charge0
Complexity369
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CCC(CC2)C(=O)O
InChI
InChI=1S/C14H23NO4/c1-13(2,3)19-12(18)15-8-14(9-15)6-4-10(5-7-14)11(16)17/h10H,4-9H2,1-3H3,(H,16,17)
InChIKey
CGBNTOUUTCHHQO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Tert-butoxycarbonyl)-2-azaspiro[3.5]nonane-7-carboxylic acid
CAS: 1363381-18-3
CID: 72207287
Formula: C14H23NO4
MW: 269.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight269.34
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass269.16270821
Monoisotopic Mass269.16270821
Topological Polar Surface Area66.8 Ų
Heavy Atom Count19
Formal Charge0
Complexity369
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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