Home Sulfos 1-methanesulfonylcyclobutane-1-carboxylic acid

1-methanesulfonylcyclobutane-1-carboxylic acid

CAS No.:
1250528-75-6
Catalog Number:
AG01BGO3
Molecular Formula:
C6H10O4S
Molecular Weight:
178.2062
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Product Description
Catalog Number:
AG01BGO3
Chemical Name:
1-methanesulfonylcyclobutane-1-carboxylic acid
CAS Number:
1250528-75-6
Molecular Formula:
C6H10O4S
Molecular Weight:
178.2062
MDL Number:
MFCD16766464
IUPAC Name:
1-methylsulfonylcyclobutane-1-carboxylic acid
InChI:
InChI=1S/C6H10O4S/c1-11(9,10)6(5(7)8)3-2-4-6/h2-4H2,1H3,(H,7,8)
InChI Key:
FJXJEGTTZDOFOK-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CCC1)S(=O)(=O)C
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.03g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.202g/mol
Monoisotopic Mass:
178.03g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties