Home Sulfos 4-(benzyloxy)-3-(propan-2-yl)benzene-1-sulfonyl chloride

4-(benzyloxy)-3-(propan-2-yl)benzene-1-sulfonyl chloride

CAS No.:
1094721-09-1
Catalog Number:
AG01EIY4
Molecular Formula:
C16H17ClO3S
Molecular Weight:
324.8224
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Product Description
Catalog Number:
AG01EIY4
Chemical Name:
4-(benzyloxy)-3-(propan-2-yl)benzene-1-sulfonyl chloride
CAS Number:
1094721-09-1
Molecular Formula:
C16H17ClO3S
Molecular Weight:
324.8224
MDL Number:
MFCD13635109
IUPAC Name:
4-phenylmethoxy-3-propan-2-ylbenzenesulfonyl chloride
InChI:
InChI=1S/C16H17ClO3S/c1-12(2)15-10-14(21(17,18)19)8-9-16(15)20-11-13-6-4-3-5-7-13/h3-10,12H,11H2,1-2H3
InChI Key:
TWOZIWXRYBLRIO-UHFFFAOYSA-N
SMILES:
CC(c1cc(ccc1OCc1ccccc1)S(=O)(=O)Cl)C
Properties
Complexity:
410  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.059g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.819g/mol
Monoisotopic Mass:
324.059g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Properties