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859776-61-7

859776-61-7 | 4-Bromophenyl-(4-methylbenzyl)ether

CAS No: 859776-61-7 Catalog No: AG01EXUV MDL No:

Product Description

Catalog Number:
AG01EXUV
Chemical Name:
4-Bromophenyl-(4-methylbenzyl)ether
CAS Number:
859776-61-7
Molecular Formula:
C14H13BrO
Molecular Weight:
277.1564
IUPAC Name:
1-bromo-4-[(4-methylphenyl)methoxy]benzene
InChI:
InChI=1S/C14H13BrO/c1-11-2-4-12(5-3-11)10-16-14-8-6-13(15)7-9-14/h2-9H,10H2,1H3
InChI Key:
XQAVCANWRFIFRM-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)COc1ccc(cc1)Br

Properties

Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.015g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.161g/mol
Monoisotopic Mass:
276.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

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