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1281658-73-8 | 2-Bromobenzyl-(3,4-dimethylphenyl)ether
CAS No: 1281658-73-8 Catalog No: AG01FCAH MDL No:
Product Description
Catalog Number:
AG01FCAH
Chemical Name:
2-Bromobenzyl-(3,4-dimethylphenyl)ether
CAS Number:
1281658-73-8
Molecular Formula:
C15H15BrO
Molecular Weight:
291.1830
IUPAC Name:
4-[(2-bromophenyl)methoxy]-1,2-dimethylbenzene
InChI:
InChI=1S/C15H15BrO/c1-11-7-8-14(9-12(11)2)17-10-13-5-3-4-6-15(13)16/h3-9H,10H2,1-2H3
InChI Key:
LVGQWWRGOKSGAH-UHFFFAOYSA-N
SMILES:
Brc1ccccc1COc1ccc(c(c1)C)C
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.031g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.188g/mol
Monoisotopic Mass:
290.031g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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