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About This Item

Linear Formula:
C6H5CH(CH3)NCO
CAS Number:
Molecular Weight:
147.17
Beilstein:
3196930
MDL number:
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product line

ChiraSelect

Assay

≥99%

optical purity

ee: ≥99% (GLC)

refractive index

n20/D 1.513 (lit.)

bp

55-56 °C/2.5 mmHg (lit.)

density

1.045 g/mL at 20 °C (lit.)

SMILES string

C[C@@H](N=C=O)c1ccccc1

InChI

1S/C9H9NO/c1-8(10-7-11)9-5-3-2-4-6-9/h2-6,8H,1H3/t8-/m1/s1

InChI key

JJSCUXAFAJEQGB-MRVPVSSYSA-N

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Legal Information

ChiraSelect is a trademark of Sigma-Aldrich Co. LLC

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Certificates of Analysis (COA)

Lot/Batch Number

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