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About This Item
Empirical Formula (Hill Notation):
C11H19ClO2
CAS Number:
Molecular Weight:
218.72
UNSPSC Code:
12352101
NACRES:
NA.22
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
2414685
Form:
liquid
form
liquid
Quality Segment
optical activity
[α]20/D +83°, c = 1 in chloroform
optical purity
ee: 97% (GLC)
refractive index
n20/D 1.458 (lit.)
bp
108-109 °C/11 mmHg (lit.)
density
1.031 g/mL at 25 °C (lit.)
functional group
chloro
storage temp.
2-8°C
SMILES string
CC(C)[C@H]1CC[C@H](C)C[C@@H]1OC(Cl)=O
InChI
1S/C11H19ClO2/c1-7(2)9-5-4-8(3)6-10(9)14-11(12)13/h7-10H,4-6H2,1-3H3/t8-,9+,10-/m0/s1
InChI key
KIUPCUCGVCGPPA-AEJSXWLSSA-N
Application
Chiral auxiliary in the asymmetric synthesis of quaternary carbon centers.
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 3 Inhalation - Skin Corr. 1B
Storage Class
6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
wgk
WGK 3
flash_point_f
158.0 °F - closed cup
flash_point_c
70 °C - closed cup
ppe
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
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