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34244-15-0 | 1-Iodopyrene
CAS No: 34244-15-0 Catalog No: AG00CHJF MDL No:
Product Description
Catalog Number:
AG00CHJF
Chemical Name:
1-Iodopyrene
CAS Number:
34244-15-0
Molecular Formula:
C16H9I
Molecular Weight:
328.1471
IUPAC Name:
1-iodopyrene
InChI:
InChI=1S/C16H9I/c17-14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H
InChI Key:
CWNJSSNWLUIMDP-UHFFFAOYSA-N
SMILES:
Ic1ccc2c3c1ccc1c3c(cc2)ccc1
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.975g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.152g/mol
Monoisotopic Mass:
327.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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