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Compound FL0197

CAT: 0931-FL0197-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-FL0197-02Size:25 mg
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CAS Number
148214-90-8
Bioactivity
Compound FL0197, with CAS No. 148214-90-8, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound FL0197 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
CC(C)(C)OC(=O)N1C[C@@H](N)[C@H](O)C1
Molecular Formula
C9H18N2O3
Molecular Weight
202.25
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(3R,4R)-3-Amino-1-Boc-4-hydroxypyrrolidine
CAS Number148214-90-8
PubChem CID11275699
IUPAC Nametert-butyl (3R,4R)-3-amino-4-hydroxypyrrolidine-1-carboxylate
Molecular FormulaC9H18N2O3
Molecular Weight202.25
XLogP-0.6
Topological Polar Surface Area75.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity225
SMILES
CC(C)(C)OC(=O)N1C[C@H]([C@@H](C1)O)N
InChI
InChI=1S/C9H18N2O3/c1-9(2,3)14-8(13)11-4-6(10)7(12)5-11/h6-7,12H,4-5,10H2,1-3H3/t6-,7-/m1/s1
InChIKey
MOZOQDNRVPHFOO-RNFRBKRXSA-N
Chemical Structure
2D Structure
2D structure of (3R,4R)-3-Amino-1-Boc-4-hydroxypyrrolidine
CAS: 148214-90-8
CID: 11275699
Formula: C9H18N2O3
MW: 202.25
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight202.25
XLogP3-0.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass202.13174244
Monoisotopic Mass202.13174244
Topological Polar Surface Area75.8 Ų
Heavy Atom Count14
Formal Charge0
Complexity225
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
FL0107-01Compound FL0107
FL0185-01Compound FL0185
FL0158-01Compound FL0158
FL0121-01Compound FL0121
FL0115-01Compound FL0115
FL0290-01Compound FL0290
FL0183-01Compound FL0183
FL0156-01Compound FL0156
FL0092-01Compound FL0092
FL0122-01Compound FL0122

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