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88154-19-2 | Pyrrolidine, 1,1'-[methylenebis(3-methyl-4,1-phenylene)]bis-
CAS No: 88154-19-2 Catalog No: AG004E67 MDL No:
Product Description
Catalog Number:
AG004E67
Chemical Name:
Pyrrolidine, 1,1'-[methylenebis(3-methyl-4,1-phenylene)]bis-
CAS Number:
88154-19-2
Molecular Formula:
C23H30N2
Molecular Weight:
334.4977
IUPAC Name:
1-[3-methyl-4-[(2-methyl-4-pyrrolidin-1-ylphenyl)methyl]phenyl]pyrrolidine
InChI:
InChI=1S/C23H30N2/c1-18-15-22(24-11-3-4-12-24)9-7-20(18)17-21-8-10-23(16-19(21)2)25-13-5-6-14-25/h7-10,15-16H,3-6,11-14,17H2,1-2H3
InChI Key:
ZCYBFDXFTQKOOA-UHFFFAOYSA-N
SMILES:
Cc1cc(ccc1Cc1ccc(cc1C)N1CCCC1)N1CCCC1
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.241g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.507g/mol
Monoisotopic Mass:
334.241g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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