3,3'-Bithiophene

C8H6S2CAS 3172-56-3166.26 g/mol

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Properties

Molecular formula
C8H6S2
Molar mass
166.26 g/mol
Exact mass
165.9911 Da
logP
3.48Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
3172-56-3
SMILES
C1=CSC=C1C2=CSC=C2
InChIKey
IAAQEGBHNXAHBF-UHFFFAOYSA-N
InChI
InChI=1S/C8H6S2/c1-3-9-5-7(1)8-2-4-10-6-8/h1-6H

Weigh it out

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Work with 3,3'-Bithiophene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Phenylthiophene2404-87-772 % similar 4-(Thiophen-3-yl)benzaldehyde157730-74-054 % similar 3-Methoxythiophene17573-92-145 % similar 3-Iodothiophene10486-61-045 % similar 3-Chlorothiophene17249-80-845 % similar Thiophen-3-amine17721-06-145 % similar 3-Methylthiophene616-44-445 % similar 3-Bromothiophene872-31-145 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,2′-Bithiophene492-97-7

Elsewhere

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