Home Halogens tert-butyl 2-bromobenzoate

tert-butyl 2-bromobenzoate

CAS No.:
55666-42-7
Catalog Number:
AG00I9XH
Molecular Formula:
C11H13BrO2
Molecular Weight:
257.1237
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$98
- +
10g
98%
In Stock USA
United States
$188
- +
25g
98%
In Stock USA
United States
$363
- +
100g
98%
In Stock USA
United States
$1188
- +
Product Description
Catalog Number:
AG00I9XH
Chemical Name:
tert-butyl 2-bromobenzoate
CAS Number:
55666-42-7
Molecular Formula:
C11H13BrO2
Molecular Weight:
257.1237
MDL Number:
MFCD00027950
IUPAC Name:
tert-butyl 2-bromobenzoate
InChI:
InChI=1S/C11H13BrO2/c1-11(2,3)14-10(13)8-6-4-5-7-9(8)12/h4-7H,1-3H3
InChI Key:
ZELNHJFYEDOWLF-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1Br)OC(C)(C)C
Properties
Complexity:
208  
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