Benzene, 1-[bis(methylthio)methyl]-4-methoxy-
Basic information
- CAS
30038-29-0- Standard SMILES
COc1ccc(C(SC)SC)cc1- InChIKey
VKESVSJKKZLEKH-UHFFFAOYSA-N- Molecular formula
- C10H14OS2
- Average molar mass
- 214.4 g/mol
- Monoisotopic mass
- 214.04860741
Names & identifiers
- Preferred name
- Benzene, 1-[bis(methylthio)methyl]-4-methoxy-
- IUPAC
- 1-[bis(methylsulfanyl)methyl]-4-methoxybenzene
Names & synonyms
Benzene, 1-[bis(methylthio)methyl]-4-methoxy-1-[bis(methylsulfanyl)methyl]-4-methoxybenzene30038-29-04-Methoxybenzaldehyde dimethyl dithioacetalDTXSID80344510VKESVSJKKZLEKH-UHFFFAOYSA-N4-[Bis(methylsulfanyl)methyl]phenyl methyl ether #
Database identifiers
- CAS
30038-29-0- PubChem CID
- 597488
- DTXSID
DTXSID80344510- Nikkaji
- J2.912.978I
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 59.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 129
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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