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893736-36-2 | Methyl 4'-(4-morpholinyl)[1,1'-biphenyl]-3-carboxylate
CAS No: 893736-36-2 Catalog No: AG01F84C MDL No:
Product Description
Catalog Number:
AG01F84C
Chemical Name:
Methyl 4'-(4-morpholinyl)[1,1'-biphenyl]-3-carboxylate
CAS Number:
893736-36-2
Molecular Formula:
C18H19NO3
Molecular Weight:
297.3484
IUPAC Name:
methyl 3-(4-morpholin-4-ylphenyl)benzoate
InChI:
InChI=1S/C18H19NO3/c1-21-18(20)16-4-2-3-15(13-16)14-5-7-17(8-6-14)19-9-11-22-12-10-19/h2-8,13H,9-12H2,1H3
InChI Key:
ZSAJJPSZYOWIFX-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1)c1ccc(cc1)N1CCOCC1
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.136g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.354g/mol
Monoisotopic Mass:
297.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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