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1309933-47-8

1309933-47-8 | 2-Bromobenzyl-(2-iso-propoxyphenyl)ether

CAS No: 1309933-47-8 Catalog No: AG01FBY8 MDL No:

Product Description

Catalog Number:
AG01FBY8
Chemical Name:
2-Bromobenzyl-(2-iso-propoxyphenyl)ether
CAS Number:
1309933-47-8
Molecular Formula:
C16H17BrO2
Molecular Weight:
321.2090
IUPAC Name:
1-bromo-2-[(2-propan-2-yloxyphenoxy)methyl]benzene
InChI:
InChI=1S/C16H17BrO2/c1-12(2)19-16-10-6-5-9-15(16)18-11-13-7-3-4-8-14(13)17/h3-10,12H,11H2,1-2H3
InChI Key:
ZNWIXOPPBHNYNP-UHFFFAOYSA-N
SMILES:
CC(Oc1ccccc1OCc1ccccc1Br)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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