Name: Name:1,2-ACEANTHRYLENEDIONE
Brand: Angene
SKU: AG003DBS
Rating: 90 (10 reviews)

1,2-ACEANTHRYLENEDIONE

CAS No.:

6373-11-1

Catalog Number:

AG003DBS

Molecular Formula:

Molecular Weight:

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Product Description

Catalog Number:

AG003DBS

Chemical Name:

1,2-ACEANTHRYLENEDIONE

CAS Number:

6373-11-1

MDL Number:

MFCD00013265

IUPAC Name:

aceanthrylene-1,2-dione

InChI:

InChI=1S/C16H8O2/c17-15-12-7-3-5-10-8-9-4-1-2-6-11(9)14(13(10)12)16(15)18/h1-8H

InChI Key:

YAIBDWAANBTYIA-UHFFFAOYSA-N

NSC Number:

245130

Properties

Complexity:

400

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

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Exact Mass:

232.052g/mol

Formal Charge:

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Molecular Weight:

232.238g/mol

Monoisotopic Mass:

232.052g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2

Literature

Title	Journal
Planarity and constraint of the carbonyl groups in 1,2-diones are determinants for selective inhibition of human carboxylesterase 1.	Journal of medicinal chemistry 20071115

Properties