Home Halogens Phenol, 2-bromo-4-methoxy-6-nitro-

Phenol, 2-bromo-4-methoxy-6-nitro-

CAS No.:
115929-59-4
Catalog Number:
AG000H48
Molecular Formula:
C7H6BrNO4
Molecular Weight:
248.0308
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Product Description
Catalog Number:
AG000H48
Chemical Name:
Phenol, 2-bromo-4-methoxy-6-nitro-
CAS Number:
115929-59-4
Molecular Formula:
C7H6BrNO4
Molecular Weight:
248.0308
MDL Number:
MFCD06797984
IUPAC Name:
2-bromo-4-methoxy-6-nitrophenol
InChI:
InChI=1S/C7H6BrNO4/c1-13-4-2-5(8)7(10)6(3-4)9(11)12/h2-3,10H,1H3
InChI Key:
GAVVLRJHVWIDPK-UHFFFAOYSA-N
SMILES:
COc1cc(Br)c(c(c1)[N+](=O)[O-])O
EC Number:
601-397-9
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.948g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.032g/mol
Monoisotopic Mass:
246.948g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties