Home Other Building Blocks 2-(1,1-dioxo-1,2-thiazolidin-2-yl)hexanoic acid

2-(1,1-dioxo-1,2-thiazolidin-2-yl)hexanoic acid

CAS No.:
1218238-57-3
Catalog Number:
AG01A1CR
Molecular Formula:
C9H17NO4S
Molecular Weight:
235.3006
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Product Description
Catalog Number:
AG01A1CR
Chemical Name:
2-(1,1-dioxo-1,2-thiazolidin-2-yl)hexanoic acid
CAS Number:
1218238-57-3
Molecular Formula:
C9H17NO4S
Molecular Weight:
235.3006
MDL Number:
MFCD12177037
IUPAC Name:
2-(1,1-dioxo-1,2-thiazolidin-2-yl)hexanoic acid
InChI:
InChI=1S/C9H17NO4S/c1-2-3-5-8(9(11)12)10-6-4-7-15(10,13)14/h8H,2-7H2,1H3,(H,11,12)
InChI Key:
MXGCACXGPOIQRA-UHFFFAOYSA-N
SMILES:
CCCCC(N1CCCS1(=O)=O)C(=O)O
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.088g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.298g/mol
Monoisotopic Mass:
235.088g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties