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140201-75-8 | Phenol, 2-iodo-3-(phenylmethoxy)-
CAS No: 140201-75-8 Catalog No: AG001C4Z MDL No:
Product Description
Catalog Number:
AG001C4Z
Chemical Name:
Phenol, 2-iodo-3-(phenylmethoxy)-
CAS Number:
140201-75-8
Molecular Formula:
C13H11IO2
Molecular Weight:
326.1297
IUPAC Name:
2-iodo-3-phenylmethoxyphenol
InChI:
InChI=1S/C13H11IO2/c14-13-11(15)7-4-8-12(13)16-9-10-5-2-1-3-6-10/h1-8,15H,9H2
InChI Key:
OYALQMBUDVWYFI-UHFFFAOYSA-N
SMILES:
Ic1c(cccc1O)OCc1ccccc1
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.98g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
326.133g/mol
Monoisotopic Mass:
325.98g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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