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Home Halogens Methyl 4-bromo-3-hydroxybenzoate

Methyl 4-bromo-3-hydroxybenzoate

CAS No.:
106291-80-9
Catalog Number:
AG0038BX
Molecular Formula:
C8H7BrO3
Molecular Weight:
231.0434
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$30
- +
5g
98%
In Stock USA
United States
$100
- +
10g
98%
In Stock USA
United States
$169
- +
25g
95%
In Stock USA
United States
$324
- +
100g
98%
In Stock USA
United States
$975
- +
Product Description
Catalog Number:
AG0038BX
Chemical Name:
Methyl 4-bromo-3-hydroxybenzoate
CAS Number:
106291-80-9
Molecular Formula:
C8H7BrO3
Molecular Weight:
231.0434
MDL Number:
MFCD08056372
IUPAC Name:
methyl 4-bromo-3-hydroxybenzoate
InChI:
InChI=1S/C8H7BrO3/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4,10H,1H3
InChI Key:
VYOFPLOREOHCDP-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)O)Br
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.958g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.045g/mol
Monoisotopic Mass:
229.958g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Methyl 5-bromo-2-hy-droxy-benzoate. Acta crystallographica. Section E, Structure reports online 20120501
Properties