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Home > Bromides > 1309932-99-7
1309932-99-7 | 4-Bromobenzyl-(4-iso-propylphenyl)ether
CAS No: 1309932-99-7 Catalog No: AG01FCAZ MDL No:
Product Description
Catalog Number:
AG01FCAZ
Chemical Name:
4-Bromobenzyl-(4-iso-propylphenyl)ether
CAS Number:
1309932-99-7
Molecular Formula:
C16H17BrO
Molecular Weight:
305.2096
IUPAC Name:
1-bromo-4-[(4-propan-2-ylphenoxy)methyl]benzene
InChI:
InChI=1S/C16H17BrO/c1-12(2)14-5-9-16(10-6-14)18-11-13-3-7-15(17)8-4-13/h3-10,12H,11H2,1-2H3
InChI Key:
ODUNHGSMWYDHFH-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)COc1ccc(cc1)C(C)C
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.046g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.215g/mol
Monoisotopic Mass:
304.046g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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