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1217237-98-3 | Phenol, 4-[1-[4-(2-aminoethoxy)phenyl]-2-phenyl-1-buten-1-yl]-
CAS No: 1217237-98-3 Catalog No: AG0015NE MDL No:
Product Description
Catalog Number:
AG0015NE
Chemical Name:
Phenol, 4-[1-[4-(2-aminoethoxy)phenyl]-2-phenyl-1-buten-1-yl]-
CAS Number:
1217237-98-3
Molecular Formula:
C24H25NO2
Molecular Weight:
359.4608
IUPAC Name:
4-[1-[4-(2-aminoethoxy)phenyl]-2-phenylbut-1-enyl]phenol
InChI:
InChI=1S/C24H25NO2/c1-2-23(18-6-4-3-5-7-18)24(19-8-12-21(26)13-9-19)20-10-14-22(15-11-20)27-17-16-25/h3-15,26H,2,16-17,25H2,1H3
InChI Key:
YCQBLTPGQSYLHD-UHFFFAOYSA-N
SMILES:
NCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O
Properties
Complexity:
453
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
359.189g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
359.469g/mol
Monoisotopic Mass:
359.189g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.8
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