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24988-37-2 | Benzene, 1-bromo-4-(2,4-dibromophenoxy)-2-methoxy-
CAS No: 24988-37-2 Catalog No: AG002Q36 MDL No:
Product Description
Catalog Number:
AG002Q36
Chemical Name:
Benzene, 1-bromo-4-(2,4-dibromophenoxy)-2-methoxy-
CAS Number:
24988-37-2
Molecular Formula:
C13H9Br3O2
Molecular Weight:
436.9214
IUPAC Name:
2,4-dibromo-1-(4-bromo-3-methoxyphenoxy)benzene
InChI:
InChI=1S/C13H9Br3O2/c1-17-13-7-9(3-4-10(13)15)18-12-5-2-8(14)6-11(12)16/h2-7H,1H3
InChI Key:
QWMFWZXQFWBTFA-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1Br)Oc1ccc(cc1Br)Br
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
435.813g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
436.925g/mol
Monoisotopic Mass:
433.815g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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