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78715-83-0

78715-83-0 Structure

78715-83-0 Structure
IdentificationBack Directory
[Name]

METHYL (S)-(+)-4 5-DIHYDRO-2-PHENYL-4-
[CAS]

78715-83-0
[Synonyms]

METHYL (S)-(+)-4 5-DIHYDRO-2-PHENYL-4-
METHYL (S)-(+)-4,5-DIHYDRO-2-PHENYL-4-OX
4-Oxazolecarboxylic acid, 4,5-dihydro-2-phenyl-, methyl ester, (4S)-
(S)-2-Phenyl-4,5-dihydrooxazole-4-carboxylic Acid Methyl Ester (~60% ee)
[Molecular Formula]

C11H11NO3
[MDL Number]

MFCD02683520
[MOL File]

78715-83-0.mol
[Molecular Weight]

205.21
Chemical PropertiesBack Directory
[Boiling point ]

131-132 °C/2 mmHg (lit.)
[density ]

1.2 g/mL at 25 °C (lit.)
[refractive index ]

n20/D 1.55(lit.)
[Fp ]

>230 °F
[storage temp. ]

-20°C Freezer
[solubility ]

Chloroform (Sparingly), DMSO (Slightly), Methanol (Slightly)
[form ]

Oil
[color ]

Pale Yellow
[Optical Rotation]

[α]20/D +118°, c = 1 in ethanol
[InChI]

1S/C11H11NO3/c1-14-11(13)9-7-15-10(12-9)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3/t9-/m0/s1
[InChIKey]

DVPGDAXTDJUMAS-VIFPVBQESA-N
[SMILES]

COC(=O)[C@@H]1COC(=N1)c2ccccc2
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

(S)-2-Phenyl-4,5-dihydrooxazole-4-carboxylic Acid Methyl Ester is useful in the synthesis of oxazoline based organocatalysts.
Spectrum DetailBack Directory
[Spectrum Detail]

METHYL (S)-(+)-4 5-DIHYDRO-2-PHENYL-4-(78715-83-0)IR
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