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Home > Bromides > 1341335-88-3
1341335-88-3 | Ethyl 2-(3-bromophenyl)sulfanylpropanoate
CAS No: 1341335-88-3 Catalog No: AG01FBK7 MDL No:MFCD17225270
Product Description
Catalog Number:
AG01FBK7
Chemical Name:
Ethyl 2-(3-bromophenyl)sulfanylpropanoate
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
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