Basic information
- CAS
40890-85-5- Standard SMILES
O=C(c1ccccc1)N(O)CN1CCOCC1- InChIKey
DCGGBZYEXJOFJD-UHFFFAOYSA-N- Molecular formula
- C12H16N2O3
- Average molar mass
- 236.27 g/mol
- Monoisotopic mass
- 236.11609238
Names & identifiers
- Preferred name
- Benzohydroxamic acid, N-morpholinomethyl-
- IUPAC
- N-hydroxy-N-(morpholin-4-ylmethyl)benzamide
- English name
- N-(4-Morpholinylmethyl)benzohydroxamic acid
- Molecular formula
- C12H16N2O3
- Molecular weight
- 236.27
Names & synonyms
N-Morpholinomethylbenzohydroxamic acidBRN 1119411BENZOHYDROXAMIC ACID, N-MORPHOLINOMETHYL-40890-85-5DTXSID20193887RefChem:326504DTXCID60116378N-hydroxy-N-[(morpholin-4-yl)methyl]benzamideN-(4-Morpholinylmethyl)benzohydroxamic acidBenzamide, N-hydroxy-N-(4-morpholinylmethyl)-
Database identifiers
- CAS
40890-85-5- PubChem CID
- 38693
- DTXSID
DTXSID20193887- Nikkaji
- J41.227I
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 53 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- Boiling point
- 388.7 · 388.7±52.0 °C(Predicted)
- Density
- 1.241 · 1.241±0.06 g/cm3(Predicted)
- pka
- 9.04 · 9.04±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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