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22898-07-3

22898-07-3 | Benzene, 1-bromo-4-(ethenylsulfonyl)-

CAS No: 22898-07-3 Catalog No: AG002LDH MDL No:

Product Description

Catalog Number:
AG002LDH
Chemical Name:
Benzene, 1-bromo-4-(ethenylsulfonyl)-
CAS Number:
22898-07-3
Molecular Formula:
C8H7BrO2S
Molecular Weight:
247.1090
IUPAC Name:
1-bromo-4-ethenylsulfonylbenzene
InChI:
InChI=1S/C8H7BrO2S/c1-2-12(10,11)8-5-3-7(9)4-6-8/h2-6H,1H2
InChI Key:
RZLQRYIBHNAGEY-UHFFFAOYSA-N
SMILES:
C=CS(=O)(=O)c1ccc(cc1)Br

Properties

Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.935g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.106g/mol
Monoisotopic Mass:
245.935g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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