4-(1H-benzo[d]imidazol-2-yl)morpholine
Basic information
- CAS
31075-58-8- Standard SMILES
c1ccc2[nH]c(N3CCOCC3)nc2c1- InChIKey
DYERGUDBIQHVKO-UHFFFAOYSA-N- Molecular formula
- C11H13N3O
- Average molar mass
- 203.24 g/mol
- Monoisotopic mass
- 203.10586205
Names & identifiers
- Preferred name
- 4-(1H-benzo[d]imidazol-2-yl)morpholine
- IUPAC
- 4-(1H-benzimidazol-2-yl)morpholine
- English name
- 2-Morpholin-4-yl-1H-benzimidazole
- Molecular formula
- C11H13N3O
- Molecular weight
- 203.24
Names & synonyms
31075-58-84-(1H-benzo[d]imidazol-2-yl)morpholine2-Morpholin-4-yl-1H-benzimidazole2-(4-morpholinyl)-1h-benzimidazole1h-benzimidazole, 2-(4-morpholinyl)-4-(1H-benzimidazol-2-yl)morpholineMFCD005695592-(morpholin-4-yl)-1H-1,3-benzodiazoleDTXSID303008682-(morpholin-4-yl)-1H-benzimidazole4-benzimidazol-2-ylmorpholineF0306-0771
Show more names
TIMTEC-BB SBB0148112-morpholino-1H-benzimidazole2-Morpholin-4-yl-1H-benzoimidazole2-(4-morpholinyl)-1H-benzimidazole(SALTDATA: FREE)
NSC1394872-morpholinobenzimidazoleOprea1_003217MLS000055287SCHEMBL2674838SCHEMBL70166944-(2-Benzimidazolyl)morpholineCHEMBL1323603
Database identifiers
- CAS
31075-58-8- PubChem CID
- 284017
- DTXSID
DTXSID30300868- ChEMBL
CHEMBL1323603- Nikkaji
- J2.755.206D
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 41.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 218
Physicochemical properties
- Boiling point
- 408.5 · 408.5±55.0 °C(Predicted)
- Density
- 1.283 · 1.283±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 11.77 · 11.77±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
3 records
Compound notes
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