Tris-(2,2,6,6-tetramethylbenzo[1,2-d:5,4-d']-bis(1,3)oxathiol-4-yl) methanol

HCID 70260507
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Basic information

Standard SMILES
CC1(C)Oc2cc3c(c(C(O)(c4c5c(cc6c4SC(C)(C)O6)OC(C)(C)S5)c4c5c(cc6c4SC(C)(C)O6)OC(C)(C)S5)c2S1)SC(C)(C)O3
InChIKey
KNTPGLOVMRRTBY-UHFFFAOYSA-N
Molecular formula
C37H40O7S6
Average molar mass
789.1 g/mol

Names & identifiers

Preferred name
Tris-(2,2,6,6-tetramethylbenzo[1,2-d:5,4-d']-bis(1,3)oxathiol-4-yl) methanol
IUPAC
tris(2,2,6,6-tetramethyl-[1,3]oxathiolo[4,5-f][1,3]benzoxathiol-4-yl)methanol

Names & synonyms

SCHEMBL8036017KNTPGLOVMRRTBY-UHFFFAOYSA-NTris-(2,2,6,6-tetramethylbenzo[1,2-d:5,4-d']-bis(1,3)oxathiol-4-yl) methanolTris-(2,2,6,6-tetramethylbenzo[1,2-d:5,4-d']-bis(1,3)oxathiol-4-yl)methanol

Database identifiers

PubChem CID
70260507

Properties

Computed structural properties

XLogP
10
Topological polar surface area
227 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
13
Rotatable bonds
3
Heavy atoms
50

Related reactions

2 records
New reaction record

Linked notes

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