Home Halogens Methyl 3-bromo-4-propoxybenzoate

Methyl 3-bromo-4-propoxybenzoate

CAS No.:
216965-51-4
Catalog Number:
AG00I47M
Molecular Formula:
C11H13BrO3
Molecular Weight:
273.1231
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$405
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Product Description
Catalog Number:
AG00I47M
Chemical Name:
Methyl 3-bromo-4-propoxybenzoate
CAS Number:
216965-51-4
Molecular Formula:
C11H13BrO3
Molecular Weight:
273.1231
MDL Number:
MFCD06801019
IUPAC Name:
methyl 3-bromo-4-propoxybenzoate
InChI:
InChI=1S/C11H13BrO3/c1-3-6-15-10-5-4-8(7-9(10)12)11(13)14-2/h4-5,7H,3,6H2,1-2H3
InChI Key:
YYRHDQVNPWMLTA-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1Br)C(=O)OC
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.005g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.126g/mol
Monoisotopic Mass:
272.005g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties