Pentanedioic acid, 2-(3-mercaptopropyl)-


Chemical Name: Pentanedioic acid, 2-(3-mercaptopropyl)-
CAS Number: 254737-29-6
Product Number: AG01E3XU(AGN-PC-006INU)
Synonyms:
MDL No:
Molecular Formula: C8H14O4S
Molecular Weight: 206.2594

Identification/Properties


Computed Properties
Molecular Weight:
206.256g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
7
Exact Mass:
206.061g/mol
Monoisotopic Mass:
206.061g/mol
Topological Polar Surface Area:
75.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
181
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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