syn-Phenanthrene-1,2-diol-3,4-oxide structure

syn-Phenanthrene-1,2-diol-3,4-oxide

(1aS,8R,9R,9aS)-1a,8,9,9a-tetrahydrophenanthro[1,2-b]oxirene-8,9-diol

Also Known As: syn-Phenanthrene-1,2-diol-3,4-oxide|Phenanthro(3,4-b)oxirene-2,3-diol, 1a,2,3,9c-tetrahydro-, (+-)|1a,8,9,9a-tetrahydrophenanthro[1,2-b]oxirene-8,9-diol|(+-)-1-beta,2-alpha-Dihydroxy-3-alpha,4-alpha-epoxy-1,2,3,4-tetrahydrophenanthrene|(+-)-3-alpha,4-alpha-Epoxy-1,2,3,4-tetrahydro-1-beta,2-alpha-phenanthrenediol|1-beta,2-alpha-Phenanthrenediol, 3-alpha,4-alpha-epoxy-1,2,3,4-tetrahydro-, (+-)-|(1aS,8R,9R,9aS)-1a,8,9,9a-tetrahydrophenanthro[1,2-b]oxirene-8,9-diol

CAS: 72074-69-2
Molecular Formula C14H12O3
Molecular Weight 228.07864 g/mol
LogP 1.0
Topological Polar Surface Area 53.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
Rotatable Bonds 0
Exact Mass 228.07864
Monoisotopic Mass 228.07864
Heavy Atoms 17
Complexity 319.0

Chemical Identifiers

CAS Number 72074-69-2
SMILES C1=CC=C2C(=C1)C=CC3=C2[C@H]([C@H]([C@H]4[C@H]3O4)O)O
InChIKey OJMOINVUODHBSF-MQYQWHSLSA-N

Product Overview

syn-Phenanthrene-1,2-diol-3,4-oxide (CAS 72074-69-2), with molecular formula C14H12O3 and molecular weight 228.07864 g/mol. IUPAC: (1aS,8R,9R,9aS)-1a,8,9,9a-tetrahydrophenanthro[1,2-b]oxirene-8,9-diol.

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