Home Halogens Ethyl 2-((3-bromophenyl)thio)propanoate

Ethyl 2-((3-bromophenyl)thio)propanoate

CAS No.:
1341335-88-3
Catalog Number:
AG01FBK7
Molecular Formula:
C11H13BrO2S
Molecular Weight:
289.1887
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$344
- +
5g
98%
1 week
United States
$927
- +
25g
98%
1 week
United States
$2573
- +
Product Description
Catalog Number:
AG01FBK7
Chemical Name:
Ethyl 2-((3-bromophenyl)thio)propanoate
CAS Number:
1341335-88-3
Molecular Formula:
C11H13BrO2S
Molecular Weight:
289.1887
MDL Number:
MFCD17225270
IUPAC Name:
ethyl 2-(3-bromophenyl)sulfanylpropanoate
InChI:
InChI=1S/C11H13BrO2S/c1-3-14-11(13)8(2)15-10-6-4-5-9(12)7-10/h4-8H,3H2,1-2H3
InChI Key:
CEZVMRKEZMUWHD-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(Sc1cccc(c1)Br)C
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.982g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.187g/mol
Monoisotopic Mass:
287.982g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties