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23094-96-4 | Benzenesulfonyl chloride, 3-bromo-4-methoxy-
CAS No: 23094-96-4 Catalog No: AG002M6R MDL No:MFCD03989643
Product Description
Catalog Number:
AG002M6R
Chemical Name:
Benzenesulfonyl chloride, 3-bromo-4-methoxy-
CAS Number:
23094-96-4
Molecular Formula:
C7H6BrClO3S
Molecular Weight:
285.5427
MDL Number:
MFCD03989643
IUPAC Name:
3-bromo-4-methoxybenzenesulfonyl chloride
InChI:
InChI=1S/C7H6BrClO3S/c1-12-7-3-2-5(4-6(7)8)13(9,10)11/h2-4H,1H3
InChI Key:
LTVLATJRJIBHDR-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Br)S(=O)(=O)Cl
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.891g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.536g/mol
Monoisotopic Mass:
283.891g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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