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756525-34-5 | Morpholine, 2-ethyl-4-[3-[4-(phenoxymethyl)phenyl]propyl]-
CAS No: 756525-34-5 Catalog No: AG005J13 MDL No:
Product Description
Catalog Number:
AG005J13
Chemical Name:
Morpholine, 2-ethyl-4-[3-[4-(phenoxymethyl)phenyl]propyl]-
CAS Number:
756525-34-5
Molecular Formula:
C22H29NO2
Molecular Weight:
339.4712
IUPAC Name:
2-ethyl-4-[3-[4-(phenoxymethyl)phenyl]propyl]morpholine
InChI:
InChI=1S/C22H29NO2/c1-2-21-17-23(15-16-24-21)14-6-7-19-10-12-20(13-11-19)18-25-22-8-4-3-5-9-22/h3-5,8-13,21H,2,6-7,14-18H2,1H3
InChI Key:
RRLSRCWBXFIFHP-UHFFFAOYSA-N
SMILES:
CCC1OCCN(C1)CCCc1ccc(cc1)COc1ccccc1
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.22g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.479g/mol
Monoisotopic Mass:
339.22g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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