Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)OCC2COc3ccccc3O2)cc1- InChIKey
OTGAYUCEDFKLHW-UHFFFAOYSA-N- Molecular formula
- C16H16O5S
- Average molar mass
- 320.4 g/mol
Names & identifiers
- Preferred name
- (2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate
- IUPAC
- 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 4-methylbenzenesulfonate
Names & synonyms
1094-91-3(2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)methyl 4-methylbenzenesulfonate(2,3-dihydro-1,4-benzodioxin-2-yl)methyl 4-methylbenzene-1-sulfonateMFCD006012222,3-dihydro-1,4-benzodioxin-2-ylmethyl 4-methylbenzenesulfonateMaybridge1_005281SCHEMBL5845241HMS556I012-tosyloxymethyl-1,4-benzodioxanOTGAYUCEDFKLHW-UHFFFAOYSA-N2,3-dihydro-1,4-benzodioxin-3-ylmethyl 4-methylbenzenesulfonateAKOS000278440
Show more names
AKOS016340223MS-2348(1,4-benzodioxan-2-yl)methyl tosylateST087938CS-03394241,4-benzodioxan-2-ylmethyl toluene4-sulphonateEN300-249515G67507
Database identifiers
- PubChem CID
- 4522296
- Nikkaji
- J1.439.912G
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 450
Related reactions
12 records
Compound notes
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