Butanoic acid, 3-hydroxy-, ethyl ester, (3S)-


Chemical Name: Butanoic acid, 3-hydroxy-, ethyl ester, (3S)-
CAS Number: 56816-01-4
Product Number: AG003Q02(AGN-PC-0OCFWY)
Synonyms:
MDL No:
Molecular Formula: C6H12O3
Molecular Weight: 132.1577

Identification/Properties


Properties
BP:
175 °C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.421(lit.)
Solubility:
Soluble in chloroform
Computed Properties
Molecular Weight:
132.159g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
132.079g/mol
Monoisotopic Mass:
132.079g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
90.3
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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#:
1993
Hazard Statements:
H227
Precautionary Statements:
P210-P280-P370+P378-P403+P235-P501
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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