CAS 522-75-8 Thioindigo - Materials / Alfa Chemistry

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Thioindigo

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Catalog Number

ACM522758-1

CAS Number

522-75-8

Product Name

Thioindigo

Structure

Category

Photochromic Materials

IUPAC Name

(2E)-2-(3-oxo-1-benzothiophen-2-ylidene)-1-benzothiophen-3-one

Molecular Weight

296.4g/mol

Molecular Formula

C16H8O2S2

Canonical SMILES

C1=CC=C2C(=C1)C(=O)C(=C3C(=O)C4=CC=CC=C4S3)S2

InChI

InChI=1S/C16H8O2S2/c17-13-9-5-1-3-7-11(9)19-15(13)16-14(18)10-6-2-4-8-12(10)20-16/h1-8H/b16-15+

InChI Key

JOUDBUYBGJYFFP-FOCLMDBBSA-N

Complexity

453

Covalently-Bonded Unit Count

EC Number

208-336-1

Exact Mass

295.996572g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms

(delta-2,2'(3H,3'H)-bibenzo(b)thiophene)-3,3'-dione;thioindigo

Monoisotopic Mass

295.996572g/mol

Rotatable Bond Count

XLogP3

4.1

MSDS

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COA

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Spec Sheet

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