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Home Nitros 5-Bromo-2-butoxy-3-nitrotoluene

5-Bromo-2-butoxy-3-nitrotoluene

CAS No.:
1381944-31-5
Catalog Number:
AG00185X
Molecular Formula:
C11H14BrNO3
Molecular Weight:
288.1378
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$300
- +
5g
96%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG00185X
Chemical Name:
5-Bromo-2-butoxy-3-nitrotoluene
CAS Number:
1381944-31-5
Molecular Formula:
C11H14BrNO3
Molecular Weight:
288.1378
MDL Number:
MFCD22375006
IUPAC Name:
5-bromo-2-butoxy-1-methyl-3-nitrobenzene
InChI:
InChI=1S/C11H14BrNO3/c1-3-4-5-16-11-8(2)6-9(12)7-10(11)13(14)15/h6-7H,3-5H2,1-2H3
InChI Key:
BUAGNQPTTFVDTK-UHFFFAOYSA-N
SMILES:
CCCCOc1c(C)cc(cc1[N+](=O)[O-])Br
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.016g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.141g/mol
Monoisotopic Mass:
287.016g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties