Home Halogens 1-bromo-4-(butan-2-yloxy)benzene

1-bromo-4-(butan-2-yloxy)benzene

CAS No.:
103323-60-0
Catalog Number:
AG019XVE
Molecular Formula:
C10H13BrO
Molecular Weight:
229.1136
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Product Description
Catalog Number:
AG019XVE
Chemical Name:
1-bromo-4-(butan-2-yloxy)benzene
CAS Number:
103323-60-0
Molecular Formula:
C10H13BrO
Molecular Weight:
229.1136
MDL Number:
MFCD11168492
IUPAC Name:
1-bromo-4-butan-2-yloxybenzene
InChI:
InChI=1S/C10H13BrO/c1-3-8(2)12-10-6-4-9(11)5-7-10/h4-8H,3H2,1-2H3
InChI Key:
WRGSCINCRHLIPC-UHFFFAOYSA-N
SMILES:
CCC(Oc1ccc(cc1)Br)C
Properties
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.015g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.117g/mol
Monoisotopic Mass:
228.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties