Home Halogens 4-bromo-2-nitro-1-(prop-2-en-1-yloxy)benzene

4-bromo-2-nitro-1-(prop-2-en-1-yloxy)benzene

CAS No.:
865716-13-8
Catalog Number:
AG01C24O
Molecular Formula:
C9H8BrNO3
Molecular Weight:
258.0687
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Product Description
Catalog Number:
AG01C24O
Chemical Name:
4-bromo-2-nitro-1-(prop-2-en-1-yloxy)benzene
CAS Number:
865716-13-8
Molecular Formula:
C9H8BrNO3
Molecular Weight:
258.0687
MDL Number:
MFCD14652185
IUPAC Name:
4-bromo-2-nitro-1-prop-2-enoxybenzene
InChI:
InChI=1S/C9H8BrNO3/c1-2-5-14-9-4-3-7(10)6-8(9)11(12)13/h2-4,6H,1,5H2
InChI Key:
XFUFDKHHPMPDRI-UHFFFAOYSA-N
SMILES:
C=CCOc1ccc(cc1[N+](=O)[O-])Br
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.969g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.071g/mol
Monoisotopic Mass:
256.969g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties