Home Sulfos propan-2-yl 2-bromobenzene-1-sulfonate

propan-2-yl 2-bromobenzene-1-sulfonate

CAS No.:
219945-37-6
Catalog Number:
AG01DW8Q
Molecular Formula:
C9H11BrO3S
Molecular Weight:
279.1508
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Product Description
Catalog Number:
AG01DW8Q
Chemical Name:
propan-2-yl 2-bromobenzene-1-sulfonate
CAS Number:
219945-37-6
Molecular Formula:
C9H11BrO3S
Molecular Weight:
279.1508
MDL Number:
MFCD25961115
IUPAC Name:
propan-2-yl 2-bromobenzenesulfonate
InChI:
InChI=1S/C9H11BrO3S/c1-7(2)13-14(11,12)9-6-4-3-5-8(9)10/h3-7H,1-2H3
InChI Key:
AISPPKSSOLMHOC-UHFFFAOYSA-N
SMILES:
CC(OS(=O)(=O)c1ccccc1Br)C
Properties
Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.961g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.148g/mol
Monoisotopic Mass:
277.961g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties