2-Methylbenzoxazole


Chemical Name: 2-Methylbenzoxazole
CAS Number: 95-21-6
Product Number: AG00IIOG(AGN-PC-0WA6Z6)
Synonyms:
MDL No:
Molecular Formula: C8H7NO
Molecular Weight: 133.14728

Identification/Properties


Computed Properties
Molecular Weight:
133.15g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
133.053g/mol
Monoisotopic Mass:
133.053g/mol
Topological Polar Surface Area:
26A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
126
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:
H227-H315-H319
Precautionary Statements:
P210-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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