Butanoic acid, 3-hydroxy-, monosodium salt, (3R)-


Chemical Name: Butanoic acid, 3-hydroxy-, monosodium salt, (3R)-
CAS Number: 13613-65-5
Product Number: AG0032DL(AGN-PC-0PKTCZ)
Synonyms:
MDL No:
Molecular Formula: C4H7NaO3
Molecular Weight: 126.0864

Identification/Properties


Properties
MP:
149-155 °C(lit.)
BP:
269.2 °C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
126.087g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
126.029g/mol
Monoisotopic Mass:
126.029g/mol
Topological Polar Surface Area:
60.4A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
73.7
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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