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About This Item
Linear Formula:
C6H10(OH)2
CAS Number:
Molecular Weight:
116.16
PubChem Substance ID:
UNSPSC Code:
12352001
Beilstein/REAXYS Number:
4780913
MDL number:
grade
puriss.
assay
≥99.0% (sum of enantiomers, GC)
optical activity
[α]20/D −39±1°, c = 1.6% in H2O
optical purity
enantiomeric ratio: ≥99:1 (GC)
mp
106-109 °C, 107-109 °C (lit.)
SMILES string
O[C@@H]1CCCC[C@H]1O
InChI
1S/C6H12O2/c7-5-3-1-2-4-6(5)8/h5-8H,1-4H2/t5-,6-/m1/s1
InChI key
PFURGBBHAOXLIO-PHDIDXHHSA-N
Packaging
Bottomless glass bottle. Contents are inside inserted fused cone.
Other Notes
Chiral auxiliary for conjugate addition reactions; Asymmetric alkylation via chiral acetals
Regulatory Information
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T. Ogawa et al.
Journal of the Chemical Society. Chemical Communications, 1438-1438 (1991)
K. Kato et al.
Tetrahedron Letters, 33, 247-247 (1992)
C. Fang et al.
The Journal of Organic Chemistry, 57, 4300-4300 (1992)
Tetrahedron Letters, 33, 3481-3481 (1992)
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