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2,2':5',2''-Terthiophene

CAT: 0957-S4982Size: 25 mgDry Ice: YesHazardous: No
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CAT#:0957-S4982Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
2,2':5',2''-Terthiophene is a natural product occurring in marigold which shows UV-enhanced antibiotic activity.
CAS Number
1081-34-1
Target
Others
Activity
Others
Molecular Formula
C12H8S3
Storage Conditions
2 years -80 in solvent

Chemical Information

2,2':5',2''-Terthiophene

2,2':5',2''-terthiophene is a terthiophene.

CAS Number1081-34-1
PubChem CID65067
IUPAC Name2,5-dithiophen-2-ylthiophene
Molecular FormulaC12H8S3
Molecular Weight248.4
XLogP4.4
Topological Polar Surface Area84.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity197
SMILES
C1=CSC(=C1)C2=CC=C(S2)C3=CC=CS3
InChI
InChI=1S/C12H8S3/c1-3-9(13-7-1)11-5-6-12(15-11)10-4-2-8-14-10/h1-8H
InChIKey
KXSFECAJUBPPFE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,2':5',2''-Terthiophene
CAS: 1081-34-1
CID: 65067
Formula: C12H8S3
MW: 248.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight248.4
XLogP34.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass247.97881378
Monoisotopic Mass247.97881378
Topological Polar Surface Area84.7 Ų
Heavy Atom Count15
Formal Charge0
Complexity197
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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Alternative Products

CatalogName
HY-N2048-012,2':5',2''-Terthiophene
OR1066569-015-Bromo-2,2':5',2''-terthiophene
4195522,2':5',2''-Terthiophene-5-carboxaldehyde
MBS3610303-0122':5'2''-Terthiophene
OR1042721-01[2,2':5',2''-Terthiophene]-5,5''-dicarboxaldehyde
OR1025484-015,5''-Diiodo-2,2':5',2''-Terthiophene
HY-N2048R-012,2':5',2''-Terthiophene (Standard)
OR10561745-Hexyl-2,2':5',2''-terthiophene
sc-2270205,5''-Dibromo-2,2':5',2''-terthiophene
sc-4770572,2':5',2''-Terthiophene-5,5''-dicarboxaldehyde

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