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850080-43-2 | Phenanthrene, 2-(iodomethyl)-
CAS No: 850080-43-2 Catalog No: AG004TEI MDL No:
Product Description
Catalog Number:
AG004TEI
Chemical Name:
Phenanthrene, 2-(iodomethyl)-
CAS Number:
850080-43-2
Molecular Formula:
C15H11I
Molecular Weight:
318.1523
IUPAC Name:
2-(iodomethyl)phenanthrene
InChI:
InChI=1S/C15H11I/c16-10-11-5-8-15-13(9-11)7-6-12-3-1-2-4-14(12)15/h1-9H,10H2
InChI Key:
UBFIYZBXJKXFHP-UHFFFAOYSA-N
SMILES:
ICc1ccc2c(c1)ccc1c2cccc1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.991g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.157g/mol
Monoisotopic Mass:
317.991g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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