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116089-86-2 | Morpholine, 4-[4-[4-(1,1,3,3-tetramethylbutyl)phenoxy]phenyl]-
CAS No: 116089-86-2 Catalog No: AG000BL7 MDL No:
Product Description
Catalog Number:
AG000BL7
Chemical Name:
Morpholine, 4-[4-[4-(1,1,3,3-tetramethylbutyl)phenoxy]phenyl]-
CAS Number:
116089-86-2
Molecular Formula:
C24H33NO2
Molecular Weight:
367.5243
IUPAC Name:
4-[4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]phenyl]morpholine
InChI:
InChI=1S/C24H33NO2/c1-23(2,3)18-24(4,5)19-6-10-21(11-7-19)27-22-12-8-20(9-13-22)25-14-16-26-17-15-25/h6-13H,14-18H2,1-5H3
InChI Key:
BEIRTGBIIUWYLW-UHFFFAOYSA-N
SMILES:
CC(CC(c1ccc(cc1)Oc1ccc(cc1)N1CCOCC1)(C)C)(C)C
Properties
Complexity:
434
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.251g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
367.533g/mol
Monoisotopic Mass:
367.251g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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