CAS 1056693-13-0 Ethyl 6-[4-(Diphenylamino)phenyl]coumarin-3-carboxylate

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Coumarin Dyes

Ethyl 6-[4-(Diphenylamino)phenyl]coumarin-3-carboxylate

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Catalog Number

ACM1056693130

Product Name

Ethyl 6-[4-(Diphenylamino)phenyl]coumarin-3-carboxylate

Structure

CAS

1056693-13-0

Category

Coumarin Dyes

IUPAC Name

ethyl 2-oxo-6-[4-(N-phenylanilino)phenyl]chromene-3-carboxylate

Molecular Weight

461.5g/mol

Molecular Formula

C30H23NO4

Canonical SMILES

CCOC(=O)C1=CC2=C(C=CC(=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5)OC1=O

InChI

InChI=1S/C30H23NO4/c1-2-34-29(32)27-20-23-19-22(15-18-28(23)35-30(27)33)21-13-16-26(17-14-21)31(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-20H,2H2,1H3

InChI Key

PQYVEQOPURSPHF-UHFFFAOYSA-N

Complexity

740

Covalently-Bonded Unit Count

Exact Mass

461.162708g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

461.162708g/mol

Rotatable Bond Count

XLogP3

7.2

MSDS

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COA

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Spec Sheet

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