Home Sulfos [3-chloro-5-(ethanesulfonyl)phenyl]methanol

[3-chloro-5-(ethanesulfonyl)phenyl]methanol

CAS No.:
1566400-39-2
Catalog Number:
AG01C2KT
Molecular Formula:
C9H11ClO3S
Molecular Weight:
234.6998
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Product Description
Catalog Number:
AG01C2KT
Chemical Name:
[3-chloro-5-(ethanesulfonyl)phenyl]methanol
CAS Number:
1566400-39-2
Molecular Formula:
C9H11ClO3S
Molecular Weight:
234.6998
MDL Number:
MFCD26051406
IUPAC Name:
(3-chloro-5-ethylsulfonylphenyl)methanol
InChI:
InChI=1S/C9H11ClO3S/c1-2-14(12,13)9-4-7(6-11)3-8(10)5-9/h3-5,11H,2,6H2,1H3
InChI Key:
NCPIPZLVUACVJQ-UHFFFAOYSA-N
SMILES:
OCc1cc(Cl)cc(c1)S(=O)(=O)CC
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.012g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.694g/mol
Monoisotopic Mass:
234.012g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties