1,3-Propanediol, 2-phenyl-


Chemical Name: 1,3-Propanediol, 2-phenyl-
CAS Number: 1570-95-2
Product Number: AG001P5Q(AGN-PC-0JNRZH)
Synonyms:
MDL No:
Molecular Formula: C9H12O2
Molecular Weight: 152.1904

Identification/Properties


Properties
MP:
53-56 °C
BP:
310.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
152.193g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
152.084g/mol
Monoisotopic Mass:
152.084g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
93.7
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:
H302-H315-H319-H332-H335
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Phenyl-1,3-Propanediol, also known as hydroxystilbamidine, is a versatile compound widely used in chemical synthesis. This compound is commonly employed as a chiral building block in the preparation of various pharmaceuticals, agrochemicals, and fine chemicals. Its unique structure and reactivity make it a valuable intermediate in the synthesis of complex organic molecules.In organic chemistry, 2-Phenyl-1,3-Propanediol serves as a key starting material for the synthesis of chiral molecules due to its chirality and ability to control stereochemistry. It can undergo various functional group transformations, such as oxidation, reduction, and substitution reactions, to introduce different chemical functionalities into the molecule. Additionally, its benzyl group can be selectively modified to direct the synthesis towards specific target compounds.Furthermore, 2-Phenyl-1,3-Propanediol is used in the preparation of pharmaceuticals such as anti-inflammatory agents, antibacterial drugs, and antiviral compounds. Its structural features make it a valuable building block for drug discovery and development, allowing chemists to design new therapeutic agents with enhanced pharmacological properties.In summary, the application of 2-Phenyl-1,3-Propanediol in chemical synthesis is essential for the efficient and selective construction of complex organic molecules with diverse applications in the pharmaceutical and agrochemical industries.