Acetic acid, (1H-indol-3-ylthio)-


Chemical Name: Acetic acid, (1H-indol-3-ylthio)-
CAS Number: 54466-88-5
Product Number: AG00D9I8(AGN-PC-0JTEU0)
Synonyms:
MDL No:
Molecular Formula: C10H9NO2S
Molecular Weight: 207.2490

Identification/Properties


Computed Properties
Molecular Weight:
207.247g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
207.035g/mol
Monoisotopic Mass:
207.035g/mol
Topological Polar Surface Area:
78.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
222
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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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