Propanoic acid, oxo-


Chemical Name: Propanoic acid, oxo-
CAS Number: 127-17-3
Product Number: AG000WIG(AGN-PC-008LF9)
Synonyms:
MDL No:
Molecular Formula: C3H4O3
Molecular Weight: 88.0621

Identification/Properties


Properties
MP:
11-12 °C(lit.)
BP:
165°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.428(lit.)
Solubility:
Miscible with chloroform and methanol.
Computed Properties
Molecular Weight:
88.062g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
88.016g/mol
Monoisotopic Mass:
88.016g/mol
Topological Polar Surface Area:
54.4A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
84
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#:
3265
Hazard Statements:
H227-H314-H318
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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