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Terfluranol

CAT: 0013-GTR19239798-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19239798-02Size:100 mg
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Description
Terfluranol is a benzyl-derived small molecule compound investigated for its antitumor properties. Research applications include in vitro studies on cancer cell lines and in vivo models to explore its potential mechanisms and efficacy as an anticancer agent.
CAS Number
64396-09-4
Smiles
[C@@H] ([C@@H] (C) C1=CC=C (O) C=C1) (CC (F) (F) F) C2=CC=C (O) C=C2
Molecular Formula
C17H17F3O2
Molecular Weight
310.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Terfluranol

Terfluranol is a small molecule drug. Terfluranol has a monoisotopic molecular weight of 310.12 Da.

CAS Number64396-09-4
PubChem CID3085293
IUPAC Name4-[(2R,3S)-5,5,5-trifluoro-3-(4-hydroxyphenyl)pentan-2-yl]phenol
Molecular FormulaC17H17F3O2
Molecular Weight310.31
XLogP5
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity329
SMILES
C[C@@H](C1=CC=C(C=C1)O)[C@H](CC(F)(F)F)C2=CC=C(C=C2)O
InChI
InChI=1S/C17H17F3O2/c1-11(12-2-6-14(21)7-3-12)16(10-17(18,19)20)13-4-8-15(22)9-5-13/h2-9,11,16,21-22H,10H2,1H3/t11-,16-/m0/s1
InChIKey
KTUJPJJUMKZGCV-ZBEGNZNMSA-N
Chemical Structure
2D Structure
2D structure of Terfluranol
CAS: 64396-09-4
CID: 3085293
Formula: C17H17F3O2
MW: 310.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight310.31
XLogP35
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass310.11806427
Monoisotopic Mass310.11806427
Topological Polar Surface Area40.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity329
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

Alternative Products

CatalogName
T200996-01Terfluranol

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