Home Halogens 1,5-dibromo-2-methoxy-4-nitrobenzene

1,5-dibromo-2-methoxy-4-nitrobenzene

CAS No.:
860585-41-7
Catalog Number:
AG01BD8P
Molecular Formula:
C7H5Br2NO3
Molecular Weight:
310.9275
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Product Description
Catalog Number:
AG01BD8P
Chemical Name:
1,5-dibromo-2-methoxy-4-nitrobenzene
CAS Number:
860585-41-7
Molecular Formula:
C7H5Br2NO3
Molecular Weight:
310.9275
MDL Number:
MFCD11869867
IUPAC Name:
1,5-dibromo-2-methoxy-4-nitrobenzene
InChI:
InChI=1S/C7H5Br2NO3/c1-13-7-3-6(10(11)12)4(8)2-5(7)9/h2-3H,1H3
InChI Key:
LLYFTAQHQDLPIT-UHFFFAOYSA-N
SMILES:
COc1cc([N+](=O)[O-])c(cc1Br)Br
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.862g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.929g/mol
Monoisotopic Mass:
308.864g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties