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About This Item
Empirical Formula (Hill Notation):
C12H22O2
CAS Number:
Molecular Weight:
198.30
PubChem Substance ID:
UNSPSC Code:
12352108
Beilstein/REAXYS Number:
1909419
MDL number:
SMILES string
CC(C)[C@H]1CC[C@H](C)C[C@@H]1OC(C)=O
InChI
1S/C12H22O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3/t9-,11+,12-/m0/s1
InChI key
XHXUANMFYXWVNG-WCQGTBRESA-N
assay
99%
form
liquid
optical activity
[α]20/D +80°, c = 8 in benzene
optical purity
ee: 98% (GLC)
refractive index
n20/D 1.446 (lit.)
bp
228-229 °C (lit.)
density
0.925 g/mL at 25 °C (lit.)
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
170.6 °F - closed cup
flash_point_c
77 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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