Pentatroxane

(4aS,7aS)-6,7a-diphenylspiro[4a,7-dihydrocyclopenta[e][1,2,4]trioxine-3,1'-cyclopentane]

Also Known As: Pentatroxane|(4aS,7aS)-6,7a-diphenylspiro[4a,7-dihydrocyclopenta[e][1,2,4]trioxine-3,1'-cyclopentane]|Spiro(cyclopentane-1,3'-(7H)cyclopenta(1,2,4)trioxin), 4'a,7'a-dihydro-6',7'a-diphenyl-, (4'aS-cis)-|(5S)-6,8-Diphenyl-5beta,6beta-propenospiro[1,2,4-trioxane-3,1 -cyclopentane]|2,3aalpha-Diphenyl-3a,7aalpha-dihydro-3H-4,5,7-trioxaspiro[6H-indene-6,1 -cyclopentane]|(4'aS,7'aS)-6',7'a-Diphenyl-7',7'a-dihydro-4'aH-spiro[cyclopentane-1,3'-cyclopenta[e][1,2,4]trioxine]|(4aS,7aS)-6,7a-diphenyl-7,7a-dihydro-4aH-spiro[cyclopenta[e][1,2,4]trioxine-3,1'-cyclopentane]|(4aS,7aS)-6,7a-Diphenylspiro[7,4a,7a-trihydrocyclopenta[2,1-e]1,2,4-trioxane-3,1'-cyclopentane]|6',7'a-Diphenyl-7',7'a-dihydro-4'aH-spiro[cyclopentane-1,3'-cyclopenta[e][1,2,4]trioxine]

Molecular Formula	C22H22O3
Molecular Weight	334.1569 g/mol
LogP	4.2
Topological Polar Surface Area	27.7 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	334.1569
Monoisotopic Mass	334.1569
Heavy Atoms	25
Complexity	509.0

Chemical Identifiers

CAS Number	124378-33-2
SMILES	C1CCC2(C1)O[C@H]3C=C(C[C@]3(OO2)C4=CC=CC=C4)C5=CC=CC=C5
InChIKey	IIBNWGMRDCFPEU-UNMCSNQZSA-N