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157126-72-2 | 1-(3-iodopropyl)-3-phenoxybenzene
CAS No: 157126-72-2 Catalog No: AG00B942 MDL No:MFCD19441075
Product Description
Catalog Number:
AG00B942
Chemical Name:
1-(3-iodopropyl)-3-phenoxybenzene
CAS Number:
157126-72-2
Molecular Formula:
C15H15IO
Molecular Weight:
338.1835
MDL Number:
MFCD19441075
IUPAC Name:
1-(3-iodopropyl)-3-phenoxybenzene
InChI:
InChI=1S/C15H15IO/c16-11-5-7-13-6-4-10-15(12-13)17-14-8-2-1-3-9-14/h1-4,6,8-10,12H,5,7,11H2
InChI Key:
BEPDABJXYZNSAZ-UHFFFAOYSA-N
SMILES:
ICCCc1cccc(c1)Oc1ccccc1
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.017g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.188g/mol
Monoisotopic Mass:
338.017g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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