5-Thiazolecarboxylic acid, 4-methyl-2-phenyl-


Chemical Name: 5-Thiazolecarboxylic acid, 4-methyl-2-phenyl-
CAS Number: 33763-20-1
Product Number: AG00I6NJ(AGN-PC-0JVFQ1)
Synonyms:
MDL No:
Molecular Formula: C11H9NO2S
Molecular Weight: 219.2597

Identification/Properties


Properties
MP:
210-212°C
BP:
424°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
219.258g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
219.035g/mol
Monoisotopic Mass:
219.035g/mol
Topological Polar Surface Area:
78.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
241
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#:
N/A
Hazard Statements:
H302-H312-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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