2-Methyl-5-sulfanylbenzene-1,4-diol
Basic information
- CAS
98277-68-0- Standard SMILES
Cc1cc(O)c(S)cc1O- InChIKey
OYLGRBGFAVGHSB-UHFFFAOYSA-N- Molecular formula
- C7H8O2S
- Average molar mass
- 156.2 g/mol
- Monoisotopic mass
- 156.02450067
Names & identifiers
- Preferred name
- 2-Methyl-5-sulfanylbenzene-1,4-diol
- IUPAC
- 2-methyl-5-sulfanylbenzene-1,4-diol
Names & synonyms
2-methyl-5-sulfanylbenzene-1,4-diolSCHEMBL16900573DTXSID5012942992-Mercapto-5-methyl-1,4-benzenediol98277-68-0
Database identifiers
- CAS
98277-68-0- PubChem CID
- 102467792
- DTXSID
DTXSID501294299- Nikkaji
- J2.328.727G
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 118
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…