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About This Item
Empirical Formula (Hill Notation):
C15H13NO2
CAS Number:
Molecular Weight:
239.27
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352005
MDL number:
InChI
1S/C15H13NO2/c17-15-16-13(11-7-3-1-4-8-11)14(18-15)12-9-5-2-6-10-12/h1-10,13-14H,(H,16,17)/t13-,14+/m1/s1
SMILES string
O=C1N[C@@H]([C@@H](O1)c2ccccc2)c3ccccc3
InChI key
LTENIVFVXMCOQI-KGLIPLIRSA-N
assay
98%
optical activity
[α]20/D 57±4°, c = 2 in methanol
mp
227-230 °C (lit.)
Application
Versatile chiral auxiliary for asymmetric synthesis. For a recent review, see Aldrichimica Acta .
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Ager, D.J., et al.
Aldrichimica Acta, 30, 3-3 (1997)
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