Acetic acid, isothiocyanato-, ethyl ester


Chemical Name: Acetic acid, isothiocyanato-, ethyl ester
CAS Number: 24066-82-8
Product Number: AG003QFM(AGN-PC-0JKMDX)
Synonyms:
MDL No: MFCD00060677
Molecular Formula: C5H7NO2S
Molecular Weight: 145.1796

Identification/Properties


Properties
Storage:
2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
145.176g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
145.02g/mol
Monoisotopic Mass:
145.02g/mol
Topological Polar Surface Area:
70.8A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
140
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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