Home Sulfos ethyl 2-sulfobutanoate

ethyl 2-sulfobutanoate

CAS No.:
1197230-06-0
Catalog Number:
AG01EIU9
Molecular Formula:
C6H11ClO4S
Molecular Weight:
214.6671
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Product Description
Catalog Number:
AG01EIU9
Chemical Name:
ethyl 2-sulfobutanoate
CAS Number:
1197230-06-0
Molecular Formula:
C6H11ClO4S
Molecular Weight:
214.6671
MDL Number:
MFCD15143102
IUPAC Name:
ethyl 2-chlorosulfonylbutanoate
InChI:
InChI=1S/C6H11ClO4S/c1-3-5(12(7,9)10)6(8)11-4-2/h5H,3-4H2,1-2H3
InChI Key:
PRMTYCQEJFNIBM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(S(=O)(=O)Cl)CC
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.007g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.66g/mol
Monoisotopic Mass:
214.007g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties