Home Halogens 2-bromo-1-(tert-butoxy)-4-nitrobenzene

2-bromo-1-(tert-butoxy)-4-nitrobenzene

CAS No.:
960309-85-7
Catalog Number:
AG00IJR9
Molecular Formula:
C10H12BrNO3
Molecular Weight:
274.1112
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00IJR9
Chemical Name:
2-bromo-1-(tert-butoxy)-4-nitrobenzene
CAS Number:
960309-85-7
Molecular Formula:
C10H12BrNO3
Molecular Weight:
274.1112
MDL Number:
MFCD20327985
IUPAC Name:
2-bromo-1-[(2-methylpropan-2-yl)oxy]-4-nitrobenzene
InChI:
InChI=1S/C10H12BrNO3/c1-10(2,3)15-9-5-4-7(12(13)14)6-8(9)11/h4-6H,1-3H3
InChI Key:
KMOHHDFKKROOFJ-UHFFFAOYSA-N
SMILES:
Brc1cc(ccc1OC(C)(C)C)N(=O)=O
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.114g/mol
Monoisotopic Mass:
273g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties