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Home > Bromides > 1309933-62-7
1309933-62-7 | 3-Bromobenzyl-(2-iso-propoxyphenyl)ether
CAS No: 1309933-62-7 Catalog No: AG01FBY9 MDL No:
Product Description
Catalog Number:
AG01FBY9
Chemical Name:
3-Bromobenzyl-(2-iso-propoxyphenyl)ether
CAS Number:
1309933-62-7
Molecular Formula:
C16H17BrO2
Molecular Weight:
321.2090
IUPAC Name:
1-bromo-3-[(2-propan-2-yloxyphenoxy)methyl]benzene
InChI:
InChI=1S/C16H17BrO2/c1-12(2)19-16-9-4-3-8-15(16)18-11-13-6-5-7-14(17)10-13/h3-10,12H,11H2,1-2H3
InChI Key:
KOLIHTWZDNKLIT-UHFFFAOYSA-N
SMILES:
CC(Oc1ccccc1OCc1cccc(c1)Br)C
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.041g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.214g/mol
Monoisotopic Mass:
320.041g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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