Acetic acid, cyano(hydroxyimino)-, ethyl ester


Chemical Name: Acetic acid, cyano(hydroxyimino)-, ethyl ester
CAS Number: 3849-21-6
Product Number: AG0034W1(AGN-PC-0LT1C2)
Synonyms:
MDL No:
Molecular Formula: C5H6N2O3
Molecular Weight: 142.1127

Identification/Properties


Properties
MP:
130-132 °C(lit.)
BP:
248.9°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5090 (estimate)
Computed Properties
Molecular Weight:
142.114g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
142.038g/mol
Monoisotopic Mass:
142.038g/mol
Topological Polar Surface Area:
82.7A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
200
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


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

NMR Spectrum


Other Analytical Data


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