Home Other Building Blocks 4-Bromo-2-methylbenzoic acid

4-Bromo-2-methylbenzoic acid

CAS No.:
68837-59-2
Catalog Number:
AG0033XN
Molecular Formula:
C8H7BrO2
Molecular Weight:
215.0440
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$10
- +
25g
95%
In Stock USA
United States
$33
- +
100g
95%
In Stock USA
United States
$94
- +
Product Description
Catalog Number:
AG0033XN
Chemical Name:
4-Bromo-2-methylbenzoic acid
CAS Number:
68837-59-2
Molecular Formula:
C8H7BrO2
Molecular Weight:
215.0440
MDL Number:
MFCD00040905
IUPAC Name:
4-bromo-2-methylbenzoic acid
InChI:
InChI=1S/C8H7BrO2/c1-5-4-6(9)2-3-7(5)8(10)11/h2-4H,1H3,(H,10,11)
InChI Key:
RVCJOGNLYVNRDN-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)C)C(=O)O
EC Number:
272-437-7
NSC Number:
243710
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.963g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.046g/mol
Monoisotopic Mass:
213.963g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties