Home Sulfos 2-methanesulfonyl-1-(methoxycarbonyl)cyclopropane-1-carboxylic acid

2-methanesulfonyl-1-(methoxycarbonyl)cyclopropane-1-carboxylic acid

CAS No.:
2059927-37-4
Catalog Number:
AG01BRIQ
Molecular Formula:
C7H10O6S
Molecular Weight:
222.2157
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Product Description
Catalog Number:
AG01BRIQ
Chemical Name:
2-methanesulfonyl-1-(methoxycarbonyl)cyclopropane-1-carboxylic acid
CAS Number:
2059927-37-4
Molecular Formula:
C7H10O6S
Molecular Weight:
222.2157
MDL Number:
MFCD30535746
IUPAC Name:
1-methoxycarbonyl-2-methylsulfonylcyclopropane-1-carboxylic acid
InChI:
InChI=1S/C7H10O6S/c1-13-6(10)7(5(8)9)3-4(7)14(2,11)12/h4H,3H2,1-2H3,(H,8,9)
InChI Key:
ASKAZURPVSXVKZ-UHFFFAOYSA-N
SMILES:
COC(=O)C1(CC1S(=O)(=O)C)C(=O)O
Properties
Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.211g/mol
Monoisotopic Mass:
222.02g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties