Basic information
- CAS
40890-89-9- Standard SMILES
COc1ccc(C(=O)N(O)CN2CCOCC2)cc1- InChIKey
ZARPAOROIWZSQE-UHFFFAOYSA-N- Molecular formula
- C13H18N2O4
- Average molar mass
- 266.29 g/mol
- Monoisotopic mass
- 266.12665706
Names & identifiers
- Preferred name
- Benzohydroxamic acid, 4-methoxy-N-morpholinomethyl-
- IUPAC
- N-hydroxy-4-methoxy-N-(morpholin-4-ylmethyl)benzamide
- English name
- 4-Methoxy-N-(4-morpholinylmethyl)benzohydroxamic acid
- Molecular formula
- C13H18N2O4
- Molecular weight
- 266.29
Names & synonyms
BRN 1128670BENZOHYDROXAMIC ACID, 4-METHOXY-N-MORPHOLINOMETHYL-4-Methoxy-N-morpholinomethylbenzohydroxamic acid40890-89-9DTXSID50193890RefChem:326499DTXCID90116381N-hydroxy-4-methoxy-N-[(morpholin-4-yl)methyl]benzamide4-Methoxy-N-(4-morpholinylmethyl)benzohydroxamic acidBenzamide, N-hydroxy-4-methoxy-N-(4-morpholinylmethyl)-
Database identifiers
- CAS
40890-89-9- PubChem CID
- 38698
- DTXSID
DTXSID50193890- Nikkaji
- J41.230I
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- Boiling point
- 437.8 · 437.8±55.0 °C(Predicted)
- Density
- 1.242 · 1.242±0.06 g/cm3(Predicted)
- pka
- 9.23 · 9.23±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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