1,4-Di(2-thienyl)-1,4-butanedione

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Catalog Number

ACM13669051

Product Name

Structure

CAS

13669-05-1

Category

Heterocyclic Organic Compound

IUPAC Name

1,4-dithiophen-2-ylbutane-1,4-dione

Molecular Weight

250.3g/mol

Molecular Formula

C12H10O2S2

Canonical SMILES

C1=CSC(=C1)C(=O)CCC(=O)C2=CC=CS2

InChI

InChI=1S/C12H10O2S2/c13-9(11-3-1-7-15-11)5-6-10(14)12-4-2-8-16-12/h1-4,7-8H,5-6H2

InChI Key

QJGKCQWQNOPAMG-UHFFFAOYSA-N

Complexity

250

Covalently-Bonded Unit Count

Exact Mass

250.012222g/mol

Formal Charge

H-Bond Acceptor

H-Bond Donor

Heavy Atom Count

Monoisotopic Mass

250.012222g/mol

NSC Number

671955

Rotatable Bond Count

XLogP3

2.9

MSDS

COA

Spec Sheet

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