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16857-93-5 | Pyrrolidine, 1,1',1''-(1,3,5-benzenetriyl)tris-
CAS No: 16857-93-5 Catalog No: AG001Y5L MDL No:
Product Description
Catalog Number:
AG001Y5L
Chemical Name:
Pyrrolidine, 1,1',1''-(1,3,5-benzenetriyl)tris-
CAS Number:
16857-93-5
Molecular Formula:
C18H27N3
Molecular Weight:
285.4271
IUPAC Name:
1-(3,5-dipyrrolidin-1-ylphenyl)pyrrolidine
InChI:
InChI=1S/C18H27N3/c1-2-8-19(7-1)16-13-17(20-9-3-4-10-20)15-18(14-16)21-11-5-6-12-21/h13-15H,1-12H2
InChI Key:
SFVZVBHRZXWPGQ-UHFFFAOYSA-N
SMILES:
C1CCN(C1)c1cc(cc(c1)N1CCCC1)N1CCCC1
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.22g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.435g/mol
Monoisotopic Mass:
285.22g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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