Home Categories METHYL (4S,5S)-DIHYDRO-5-METHYL-2-PHENYL-4-OXAZOLECARBOXYLATE
LN-244121

METHYL (4S,5S)-DIHYDRO-5-METHYL-2-PHENYL-4-OXAZOLECARBOXYLATE , 0.99 , 82659-84-5

CAS NO.:82659-84-5

Empirical Formula: C12H13NO3

Molecular Weight: 219.24

MDL number: MFCD00082397

Update time: 2023-04-23

PRODUCT Properties

Melting point: 74-76 °C (lit.)
Boiling point: 110-115 °C/0.01 mmHg (lit.)
Density  1.1825 (rough estimate)
refractive index  1.5270 (estimate)
pka 2.66±0.70(Predicted)
optical activity [α]19/D +66°, c = 8 in ethanol
InChI 1S/C12H13NO3/c1-8-10(12(14)15-2)13-11(16-8)9-6-4-3-5-7-9/h3-8,10H,1-2H3/t8-,10-/m0/s1
InChIKey YBKQIWQAEPMIFG-WPRPVWTQSA-N
SMILES COC(=O)[C@H]1N=C(O[C@H]1C)c2ccccc2

Safety

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P305+P351+P338
target organs Respiratory system
PPE dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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