Benzoxazole, 2-ethyl-5-nitro-


Chemical Name: Benzoxazole, 2-ethyl-5-nitro-
CAS Number: 204771-74-4
Product Number: AG0029OP(AGN-PC-0KKPML)
Synonyms:
MDL No: MFCD03791185
Molecular Formula: C9H8N2O3
Molecular Weight: 192.1714

Identification/Properties


Computed Properties
Molecular Weight:
192.174g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
192.053g/mol
Monoisotopic Mass:
192.053g/mol
Topological Polar Surface Area:
71.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
229
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
Precautionary Statements:
P301+P312+P330
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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