Home Halogens Methyl 3-bromo-5-methoxybenzoate

Methyl 3-bromo-5-methoxybenzoate

CAS No.:
56709-70-7
Catalog Number:
AG00ECKH
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$313
- +
5g
98%
In Stock USA
United States
$1094
- +
Product Description
Catalog Number:
AG00ECKH
Chemical Name:
Methyl 3-bromo-5-methoxybenzoate
CAS Number:
56709-70-7
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
MDL Number:
MFCD11042779
IUPAC Name:
methyl 3-bromo-5-methoxybenzoate
InChI:
InChI=1S/C9H9BrO3/c1-12-8-4-6(9(11)13-2)3-7(10)5-8/h3-5H,1-2H3
InChI Key:
RVXGLLDVLYTBGN-UHFFFAOYSA-N
SMILES:
COc1cc(Br)cc(c1)C(=O)OC
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.974g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.072g/mol
Monoisotopic Mass:
243.974g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties