ChemicalBook--->CAS DataBase List--->103548-16-9

103548-16-9

103548-16-9 Structure

103548-16-9 Structure
IdentificationBack Directory
[Name]

(R)-1-PHENYL-1,3-PROPANEDIOL
[CAS]

103548-16-9
[Synonyms]

(R)-PHENYL-1,3-PROPANEDIOL
(R)-1-PHENYL-1,3-PROPANEDIOL
R(+)-1-PHENYL-1,3-PROPANEDIOL
(R)-1-Phenyl-1,3-propanediol,98%
[Molecular Formula]

C9H12O2
[MDL Number]

MFCD00145213
[MOL File]

103548-16-9.mol
[Molecular Weight]

152.19
Chemical PropertiesBack Directory
[Appearance]

WHITE CRYSTALLINE SOLID
[Melting point ]

62-66 °C
[Boiling point ]

234.66°C (rough estimate)
[density ]

1.0505 (rough estimate)
[refractive index ]

1.4910 (estimate)
[form ]

Crystalline Solid
[pka]

13.95±0.20(Predicted)
[color ]

White
[Optical Rotation]

[α]20/D +69±2°, c = 1% in chloroform
[BRN ]

4741114
[InChI]

1S/C9H12O2/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5,9-11H,6-7H2/t9-/m1/s1
[InChIKey]

RRVFYOSEKOTFOG-SECBINFHSA-N
[SMILES]

OCC[C@@H](O)c1ccccc1
Hazard InformationBack Directory
[Chemical Properties]

WHITE CRYSTALLINE SOLID
[Uses]

(1R)-1-Phenyl-1,3-propanediol is used in the synthesis and characterization of cytochrome P450 3A-activated prodrugs which are useful for targeting phosph(on)ate-based drugs to liver. It is also used in the synthesis of 1,3-diols by diarylprolinol-catalyzed aldol reaction of acetaldehyde with aldehydes followed by reduction.
Safety DataBack Directory
[Safety Statements ]

24/25
[WGK Germany ]

3
[HS Code ]

29062900
[Storage Class]

13 - Non Combustible Solids
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