Pentanoic acid, 2-hydroxy-4-methyl-, ethyl ester


Chemical Name: Pentanoic acid, 2-hydroxy-4-methyl-, ethyl ester
CAS Number: 10348-47-7
Product Number: AG003Q49(AGN-PC-00LMMM)
Synonyms:
MDL No:
Molecular Formula: C8H16O3
Molecular Weight: 160.2108

Identification/Properties


Properties
BP:
197.4°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
1.4220 to 1.4260
Computed Properties
Molecular Weight:
160.213g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
160.11g/mol
Monoisotopic Mass:
160.11g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
121
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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:
H319
Precautionary Statements:
P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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