Home Sulfos 3-(butan-2-yloxy)benzene-1-sulfonyl chloride

3-(butan-2-yloxy)benzene-1-sulfonyl chloride

CAS No.:
69129-62-0
Catalog Number:
AG01B6B7
Molecular Formula:
C10H13ClO3S
Molecular Weight:
248.7264
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Product Description
Catalog Number:
AG01B6B7
Chemical Name:
3-(butan-2-yloxy)benzene-1-sulfonyl chloride
CAS Number:
69129-62-0
Molecular Formula:
C10H13ClO3S
Molecular Weight:
248.7264
MDL Number:
MFCD14659461
IUPAC Name:
3-butan-2-yloxybenzenesulfonyl chloride
InChI:
InChI=1S/C10H13ClO3S/c1-3-8(2)14-9-5-4-6-10(7-9)15(11,12)13/h4-8H,3H2,1-2H3
InChI Key:
NMPIJVJGPLCDGF-UHFFFAOYSA-N
SMILES:
CCC(Oc1cccc(c1)S(=O)(=O)Cl)C
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.027g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.721g/mol
Monoisotopic Mass:
248.027g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties