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935745-06-5 | 1-[3-(4-IODOPHENOXY)PROPYL]-2-METHYLPYRROLIDINE
CAS No: 935745-06-5 Catalog No: AG01DFLT MDL No:MFCD26399744
Product Description
Catalog Number:
AG01DFLT
Chemical Name:
1-[3-(4-IODOPHENOXY)PROPYL]-2-METHYLPYRROLIDINE
CAS Number:
935745-06-5
Molecular Formula:
C14H20INO
Molecular Weight:
345.2192
MDL Number:
MFCD26399744
IUPAC Name:
1-[3-(4-iodophenoxy)propyl]-2-methylpyrrolidine
InChI:
InChI=1S/C14H20INO/c1-12-4-2-9-16(12)10-3-11-17-14-7-5-13(15)6-8-14/h5-8,12H,2-4,9-11H2,1H3
InChI Key:
UTRJNWWLPXDHJU-UHFFFAOYSA-N
SMILES:
Ic1ccc(cc1)OCCCN1CCCC1C
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.059g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
345.224g/mol
Monoisotopic Mass:
345.059g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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