4-Thiazolecarbonitrile


Chemical Name: 4-Thiazolecarbonitrile
CAS Number: 1452-15-9
Product Number: AG007K3E(AGN-PC-0JKC2Q)
Synonyms:
MDL No:
Molecular Formula: C4H2N2S
Molecular Weight: 110.1371

Identification/Properties


Computed Properties
Molecular Weight:
110.134g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
109.994g/mol
Monoisotopic Mass:
109.994g/mol
Topological Polar Surface Area:
64.9A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
104
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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