CAS 2038-05-3 N-Benzyl-2-morpholinoethanamine (HCID 4719951)

Substructure search Find similar structures

Basic information

CAS: 2038-05-3
Standard SMILES: c1ccc(CNCCN2CCOCC2)cc1
InChIKey: MSFAUJOUPQMLNF-UHFFFAOYSA-N
Molecular formula: C13H20N2O
Average molar mass: 220.31 g/mol
Monoisotopic mass: 220.15756326

Names & identifiers

Preferred name: N-Benzyl-2-morpholinoethanamine
IUPAC: N-benzyl-2-morpholin-4-ylethanamine
English name: N-Benzyl-2-MorpholinoethanaMine
Molecular formula: C13H20N2O
Molecular weight: 220.31

Names & synonyms

N-Benzyl-2-morpholinoethanamine2038-05-3DTXSID40405954RefChem:363293DTXCID90356806benzyl[2-(morpholin-4-yl)ethyl]amine4-Morpholineethanamine, N-(phenylmethyl)-N-benzyl-2-morpholin-4-ylethanamineN-benzyl-2-morpholinoethan-1-amineMFCD07364927N-benzyl-N-[2-(4-morpholinyl)ethyl]amineSCHEMBL39631

Show more names

4-(N-benzyl-2-aminoethyl)morpholine

SCHEMBL3037168SCHEMBL8819212N-benzyl-2-morpholino-ethanamineMSFAUJOUPQMLNF-UHFFFAOYSA-NSTK294204AKOS000238303N-benzyl-2-(morpholin-4-yl)ethanamineAS-64874

Database identifiers

CAS: 2038-05-3
PubChem CID: 4719951
DTXSID: DTXSID40405954
EC Number: 189-830-3
Nikkaji: J1.165.317K

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 24.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 5
Heavy atoms: 16
Formal charge: 0
Complexity: 175

Physicochemical properties

Boiling point: 336.6 · 336.6±27.0 °C(Predicted)
Density: 1.038 · 1.038±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka: 9.3 · 9.30±0.19(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319
Precautionary statements: P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313