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About This Item
Linear Formula:
C6H5CH2CH2CH(OH)CO2H
CAS Number:
Molecular Weight:
180.20
UNSPSC Code:
12352000
Beilstein/REAXYS Number:
3201296
MDL number:
grade
puriss.
assay
≥99.0% (sum of enantiomers, HPLC)
optical activity
[α]20/D −9.5±1°, c = 2.8% in ethanol
mp
114-117 °C
SMILES string
O[C@H](CCc1ccccc1)C(O)=O
InChI
1S/C10H12O3/c11-9(10(12)13)7-6-8-4-2-1-3-5-8/h1-5,9,11H,6-7H2,(H,12,13)/t9-/m1/s1
InChI key
JNJCEALGCZSIGB-SECBINFHSA-N
Other Notes
Chiral building block; the triflate of the corresponding ester is used for preparing ACE inhibitors
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M.R. Attwood et al.
Journal of the Chemical Society. Perkin Transactions 1, 1011-1011 (1986)
G.A. Flynn et al.
Journal of the American Chemical Society, 109, 7914-7914 (1987)
H. Urbach et al.
Tetrahedron Letters, 25, 1143-1143 (1984)
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