Acetic acid, nitro-, ethyl ester


Chemical Name: Acetic acid, nitro-, ethyl ester
CAS Number: 626-35-7
Product Number: AG0034WM(AGN-PC-0JL8ZI)
Synonyms:
MDL No:
Molecular Formula: C4H7NO4
Molecular Weight: 133.1027

Identification/Properties


Properties
BP:
208.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.424(lit.)
Computed Properties
Molecular Weight:
133.103g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
133.038g/mol
Monoisotopic Mass:
133.038g/mol
Topological Polar Surface Area:
72.1A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
116
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


PNMR/ETHYL_NITROACETATE-626-35-7-hnmr.pdf

Other Analytical Data


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