4-Oxazolecarboxylicacid, 2-(1-methylethyl)-


Chemical Name: 4-Oxazolecarboxylicacid, 2-(1-methylethyl)-
CAS Number: 153180-21-3
Product Number: AG00HY40(AGN-PC-0034W6)
Synonyms:
MDL No:
Molecular Formula: C7H9NO3
Molecular Weight: 155.15126

Identification/Properties


Computed Properties
Molecular Weight:
155.153g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
155.058g/mol
Monoisotopic Mass:
155.058g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
158
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:
Danger
UN#:
2811
Hazard Statements:
H301
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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