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IDPH-8261

CAT: 0013-GTR19273629-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19273629-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
IDPH-8261 is an orally active nonsteroidal anti-inflammatory drug (NSAID) . It is applicable for research related to inflammation, such as in studies of arthritis.
CAS Number
108912-17-0
Smiles
O=C (OC) C (C1=CC=C (C=C1) C2=CSC=C2) C
Molecular Formula
C14H14O2S
Molecular Weight
246.32
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Idph 8261

structure given in first source

CAS Number108912-17-0
PubChem CID130978
IUPAC Namemethyl 2-(4-thiophen-3-ylphenyl)propanoate
Molecular FormulaC14H14O2S
Molecular Weight246.33
XLogP3.6
Topological Polar Surface Area54.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count17
Formal Charge0
Complexity259
SMILES
CC(C1=CC=C(C=C1)C2=CSC=C2)C(=O)OC
InChI
InChI=1S/C14H14O2S/c1-10(14(15)16-2)11-3-5-12(6-4-11)13-7-8-17-9-13/h3-10H,1-2H3
InChIKey
WINXAKJYORVNHU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Idph 8261
CAS: 108912-17-0
CID: 130978
Formula: C14H14O2S
MW: 246.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight246.33
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass246.07145086
Monoisotopic Mass246.07145086
Topological Polar Surface Area54.5 Ų
Heavy Atom Count17
Formal Charge0
Complexity259
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
HY-105121IDPH-8261

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