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127704-26-1 | Phenol, 2-(di-4-morpholinylmethyl)-
CAS No: 127704-26-1 Catalog No: AG000XBD MDL No:
Product Description
Catalog Number:
AG000XBD
Chemical Name:
Phenol, 2-(di-4-morpholinylmethyl)-
CAS Number:
127704-26-1
Molecular Formula:
C15H22N2O3
Molecular Weight:
278.3468
IUPAC Name:
2-(dimorpholin-4-ylmethyl)phenol
InChI:
InChI=1S/C15H22N2O3/c18-14-4-2-1-3-13(14)15(16-5-9-19-10-6-16)17-7-11-20-12-8-17/h1-4,15,18H,5-12H2
InChI Key:
FPGCNELEVRCISV-UHFFFAOYSA-N
SMILES:
Oc1ccccc1C(N1CCOCC1)N1CCOCC1
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.163g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.352g/mol
Monoisotopic Mass:
278.163g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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