Dodecahydro-1,4:5,8-dimethanoanthracene-9,10-dione - CAS 66513-31-3

Name: Dodecahydro-1,4:5,8-dimethanoanthracene-9,10-dione
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB033046
Product Name:	Dodecahydro-1,4:5,8-dimethanoanthracene-9,10-dione
CAS:	66513-31-3
Synonyms:	pentacyclo[10.2.1.1^{5,8}.0^{2,11}.0^{4,9}]hexadecane-3,10-dione; pentacyclo[10.2.1.1^{5,8}.0^{2,11}.0^{4,9}]hexadecane-3,10-dione

Technical Data

IUPAC Name:	pentacyclo[10.2.1.15,8.02,11.04,9]hexadecane-3,10-dione
Description:	Dodecahydro-1,4:5,8-dimethanoanthracene-9,10-dione (CAS# 66513-31-3 ) is a useful research chemical.
Molecular Weight:	244.33
Molecular Formula:	C16H20O2
Canonical SMILES:	C1CC2CC1C3C2C(=O)C4C5CCC(C5)C4C3=O
InChI:	InChI=1S/C16H20O2/c17-15-11-7-1-2-8(5-7)12(11)16(18)14-10-4-3-9(6-10)13(14)15/h7-14H,1-6H2
InChI Key:	VUPXFCMAVVIOEV-UHFFFAOYSA-N
Boiling Point:	402.5 °C at 760 mmHg
Density:	1.216 g/cm³
LogP:	2.46280

Publication Number	Title	Priority Date
US-10637099-B2	Annulated tetra-substituted hydroquinone ether-based redox shuttle additives for lithium-ion batteries	20170517
US-2018337428-A1	Annulated tetra-substituted hydroquinone ether-based redox shuttle additives for lithium-ion batteries	20170517
JP-2010184898-A	Dodecahydro-1,4: 5,8-dimethanoanthracene-9,10-dione-2,3,6,7-tetracarboxylic acid-2,3: 6,7-dianhydrides, dodecahydro-1 , 4: 5,8-dimethanoanthracene-9,10-dione-2,3,6,7-tetracarboxylic acid tetraesters and method for producing the same	20090212
US-4146559-A	Cycloaliphatic diamines	19760827

Complexity:	376
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	244.146329876
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	244.146329876
Rotatable Bond Count:	0
Topological Polar Surface Area:	34.1
Undefined Atom Stereocenter Count:	8
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9