Home Halogens Methyl 3-bromo-4-isopropylbenzoate

Methyl 3-bromo-4-isopropylbenzoate

CAS No.:
318528-55-1
Catalog Number:
AG00CHV5
Molecular Formula:
C11H13BrO2
Molecular Weight:
257.1237
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$100
- +
250mg
95%
In Stock USA
United States
$188
- +
1g
95%
In Stock USA
United States
$438
- +
5g
95%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG00CHV5
Chemical Name:
Methyl 3-bromo-4-isopropylbenzoate
CAS Number:
318528-55-1
Molecular Formula:
C11H13BrO2
Molecular Weight:
257.1237
MDL Number:
MFCD11112995
IUPAC Name:
methyl 3-bromo-4-propan-2-ylbenzoate
InChI:
InChI=1S/C11H13BrO2/c1-7(2)9-5-4-8(6-10(9)12)11(13)14-3/h4-7H,1-3H3
InChI Key:
KVBRRJZVELPSOL-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)Br)C(C)C
Properties
Complexity:
204  
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:
3.6  
Properties