Acetohydroxamic acid, 2-(p-butylthio)phenyl-
Basic information
- CAS
2385-93-5- Standard SMILES
CCCCSc1ccc(CC(=O)NO)cc1- InChIKey
PWCXFVBAQLRQEN-UHFFFAOYSA-N- Molecular formula
- C12H17NO2S
- Average molar mass
- 239.34 g/mol
- Monoisotopic mass
- 239.09799996
Names & identifiers
- Preferred name
- Acetohydroxamic acid, 2-(p-butylthio)phenyl-
- IUPAC
- 2-(4-butylsulfanylphenyl)-N-hydroxyacetamide
- English name
- 2-[4-(Butylthio)phenyl]acetohydroxamic acid
- Molecular formula
- C12H17NO2S
- Molecular weight
- 239.33
Names & synonyms
2385-93-5BRN 2646849ACETOHYDROXAMIC ACID, 2-(p-BUTYLTHIO)PHENYL-2-(p-Butylthio)phenylacetohydroxamic acidDTXSID20178553RefChem:316794DTXCID801010442-[4-(Butylthio)phenyl]acetohydroxamic acid2-[4-(BUTYLSULFANYL)PHENYL]-N-HYDROXYACETAMIDEBenzeneacetamide, 4-(butylthio)-N-hydroxy-
Database identifiers
- CAS
2385-93-5- PubChem CID
- 16946
- DTXSID
DTXSID20178553- Nikkaji
- J55.166J
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 203
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Compound notes
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