n-Hydroxy-4-methylsulfanyl-benzamidine
Basic information
- CAS
500024-30-6- Standard SMILES
CSc1ccc(C(N)=NO)cc1- InChIKey
FERZLTOGCPKONO-UHFFFAOYSA-N- Molecular formula
- C8H10N2OS
- Average molar mass
- 182.25 g/mol
- Monoisotopic mass
- 182.05138412
Names & identifiers
- Preferred name
- n-Hydroxy-4-methylsulfanyl-benzamidine
- IUPAC
- N'-hydroxy-4-methylsulfanylbenzenecarboximidamide
- English name
- 4-Methylsulfanylbenzamide oxime
- Molecular formula
- C8H10N2OS
- Molecular weight
- 182.24
Names & synonyms
n-hydroxy-4-methylsulfanyl-benzamidineDTXSID10399694RefChem:364204DTXCID40350551500024-30-64-MethylsulfanylbenzamideoximeSCHEMBL4106789SCHEMBL19047549FERZLTOGCPKONO-UHFFFAOYSA-NN-Hydroxy-4-(methylthio)benzenecarboximidamideBenzenecarboximidamide, N-hydroxy-4-(methylthio)-N'-hydroxy-4-(methylsulfanyl)benzenecarboximidamide
Database identifiers
- CAS
500024-30-6- PubChem CID
- 4131701
- DTXSID
DTXSID10399694
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 83.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 164
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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