Home Halogens Benzoic acid, 2-bromo-4-methyl-, ethyl ester

Benzoic acid, 2-bromo-4-methyl-, ethyl ester

CAS No.:
155694-82-9
Catalog Number:
AG001O3Y
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$391
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Product Description
Catalog Number:
AG001O3Y
Chemical Name:
Benzoic acid, 2-bromo-4-methyl-, ethyl ester
CAS Number:
155694-82-9
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
MDL Number:
MFCD06204788
IUPAC Name:
ethyl 2-bromo-4-methylbenzoate
InChI:
InChI=1S/C10H11BrO2/c1-3-13-10(12)8-5-4-7(2)6-9(8)11/h4-6H,3H2,1-2H3
InChI Key:
DGEYHLPWGQVMQQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cc1Br)C
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.994g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.1g/mol
Monoisotopic Mass:
241.994g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties