5-Methoxy-3-benzo[b]furanpropanol tosylate

HCID 19081430
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc2occ(CCCOS(=O)(=O)c3ccc(C)cc3)c2c1
InChIKey
GZYXVJMZESOJOC-UHFFFAOYSA-N
Molecular formula
C19H20O5S
Average molar mass
360.4 g/mol
Monoisotopic mass
360.10314491

Names & identifiers

Preferred name
5-Methoxy-3-benzo[b]furanpropanol tosylate
IUPAC
3-(5-methoxy-1-benzofuran-3-yl)propyl 4-methylbenzenesulfonate

Names & synonyms

SCHEMBL8649534GZYXVJMZESOJOC-UHFFFAOYSA-N5-methoxy-3-benzo[b]furanpropanol tosylate

Database identifiers

PubChem CID
19081430

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
74.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
25

Related reactions

2 records
New reaction record

Compound notes

Loading…