6-[[3-(N,N-dimethylamino)-phenyloxy]methyl]-1,2-dithiin

HCID 86751069
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C)c1cccc(OCC2=CC=CSS2)c1
InChIKey
MVRYVTVQCIQRPZ-UHFFFAOYSA-N
Molecular formula
C13H15NOS2
Average molar mass
265.4 g/mol

Names & identifiers

Preferred name
6-[[3-(N,N-dimethylamino)-phenyloxy]methyl]-1,2-dithiin
IUPAC
3-(dithiin-3-ylmethoxy)-N,N-dimethylaniline

Names & synonyms

MVRYVTVQCIQRPZ-UHFFFAOYSA-N6-[[3-(N,N-dimethylamino)-phenyloxy]methyl]-1,2-dithiin

Database identifiers

PubChem CID
86751069

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
63.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
17

Related reactions

1 records
New reaction record

Linked notes

Loading…