Acetic acid, (acetyloxy)-


Chemical Name: Acetic acid, (acetyloxy)-
CAS Number: 13831-30-6
Product Number: AG0018IQ(AGN-PC-0JLUR9)
Synonyms:
MDL No:
Molecular Formula: C4H6O4
Molecular Weight: 118.0880

Identification/Properties


Computed Properties
Molecular Weight:
118.088g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
118.027g/mol
Monoisotopic Mass:
118.027g/mol
Topological Polar Surface Area:
63.6A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
107
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#:
3261
Hazard Statements:
H314-H318
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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