Home Halogens Benzene, 1-bromo-3-(hexyloxy)-

Benzene, 1-bromo-3-(hexyloxy)-

CAS No.:
161291-04-9
Catalog Number:
AG001SAS
Molecular Formula:
C12H17BrO
Molecular Weight:
257.1668
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Product Description
Catalog Number:
AG001SAS
Chemical Name:
Benzene, 1-bromo-3-(hexyloxy)-
CAS Number:
161291-04-9
Molecular Formula:
C12H17BrO
Molecular Weight:
257.1668
MDL Number:
MFCD09037830
IUPAC Name:
1-bromo-3-hexoxybenzene
InChI:
InChI=1S/C12H17BrO/c1-2-3-4-5-9-14-12-8-6-7-11(13)10-12/h6-8,10H,2-5,9H2,1H3
InChI Key:
JVYXVTVHYHKYSY-UHFFFAOYSA-N
SMILES:
CCCCCCOc1cccc(c1)Br
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.046g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.171g/mol
Monoisotopic Mass:
256.046g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2  
Properties