Home Halogens 4-(4-bromophenoxy)-1lambda6-thiane-1,1-dione

4-(4-bromophenoxy)-1lambda6-thiane-1,1-dione

CAS No.:
2001951-51-3
Catalog Number:
AG01DW53
Molecular Formula:
C11H13BrO3S
Molecular Weight:
305.1881
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Product Description
Catalog Number:
AG01DW53
Chemical Name:
4-(4-bromophenoxy)-1lambda6-thiane-1,1-dione
CAS Number:
2001951-51-3
Molecular Formula:
C11H13BrO3S
Molecular Weight:
305.1881
MDL Number:
MFCD31615858
IUPAC Name:
4-(4-bromophenoxy)thiane 1,1-dioxide
InChI:
InChI=1S/C11H13BrO3S/c12-9-1-3-10(4-2-9)15-11-5-7-16(13,14)8-6-11/h1-4,11H,5-8H2
InChI Key:
PAAFHJDGXKZVNT-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)OC1CCS(=O)(=O)CC1
Properties
Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.977g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.186g/mol
Monoisotopic Mass:
303.977g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties