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About This Item
Empirical Formula (Hill Notation):
C6H13N
CAS Number:
Molecular Weight:
99.17
PubChem Substance ID:
UNSPSC Code:
12352005
Beilstein/REAXYS Number:
4652641
MDL number:
assay
≥97.0% (GC)
optical activity
[α]20/D −19.0±1.5°, c = 2% in methylene chloride
refractive index
n20/D 1.431
density
0.852 g/mL at 20 °C (lit.)
storage temp.
2-8°C
SMILES string
C[C@@H]1CC[C@@H](C)N1
InChI
1S/C6H13N/c1-5-3-4-6(2)7-5/h5-7H,3-4H2,1-2H3/t5-,6-/m1/s1
InChI key
ZEBFPAXSQXIPNF-PHDIDXHHSA-N
Packaging
Bottomless glass bottle. Contents are inside inserted fused cone.
Other Notes
Important chiral auxiliary with a pseudo C2 axis; diastereoselective alkylation of ketone enamines ; Highly stereoselective addition reactions of the enamine of β-keto esters (vinylogous urethanes) ; Radical reactions of unsaturated amides
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Flam. Liq. 2 - Skin Corr. 1B
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
44.6 °F - closed cup
flash_point_c
7.0 °C - closed cup
ppe
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
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