Home Halogens tert-Butyl 4-bromobenzoate

tert-Butyl 4-bromobenzoate

CAS No.:
59247-47-1
Catalog Number:
AG00E9QV
Molecular Formula:
C11H13BrO2
Molecular Weight:
257.1237
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$23
- +
5g
95%
In Stock USA
United States
$69
- +
10g
95%
In Stock USA
United States
$132
- +
25g
95%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG00E9QV
Chemical Name:
tert-Butyl 4-bromobenzoate
CAS Number:
59247-47-1
Molecular Formula:
C11H13BrO2
Molecular Weight:
257.1237
MDL Number:
MFCD00093266
IUPAC Name:
tert-butyl 4-bromobenzoate
InChI:
InChI=1S/C11H13BrO2/c1-11(2,3)14-10(13)8-4-6-9(12)7-5-8/h4-7H,1-3H3
InChI Key:
BFJJYXUCGYOXDM-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Br)OC(C)(C)C
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.01g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.127g/mol
Monoisotopic Mass:
256.01g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties