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20744-11-0 | Benzene, 1-[(6-bromohexyl)oxy]-4-methoxy-
CAS No: 20744-11-0 Catalog No: AG002J1W MDL No:
Product Description
Catalog Number:
AG002J1W
Chemical Name:
Benzene, 1-[(6-bromohexyl)oxy]-4-methoxy-
CAS Number:
20744-11-0
Molecular Formula:
C13H19BrO2
Molecular Weight:
287.1928
IUPAC Name:
1-(6-bromohexoxy)-4-methoxybenzene
InChI:
InChI=1S/C13H19BrO2/c1-15-12-6-8-13(9-7-12)16-11-5-3-2-4-10-14/h6-9H,2-5,10-11H2,1H3
InChI Key:
YGHAMCWRCXLFCH-UHFFFAOYSA-N
SMILES:
BrCCCCCCOc1ccc(cc1)OC
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.057g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.197g/mol
Monoisotopic Mass:
286.057g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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