Propanoic acid, 3-hydroxy-, 1,1-dimethylethyl ester


Chemical Name: Propanoic acid, 3-hydroxy-, 1,1-dimethylethyl ester
CAS Number: 59854-11-4
Product Number: AG003UJP(AGN-PC-00UR8Y)
Synonyms:
MDL No:
Molecular Formula: C7H14O3
Molecular Weight: 146.1843

Identification/Properties


Properties
Storage:
2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.424
Computed Properties
Molecular Weight:
146.186g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
146.094g/mol
Monoisotopic Mass:
146.094g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
113
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#:
N/A
Hazard Statements:
H227-H315-H319-H335
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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