8.18105
1,1,3,3-Tetramethylbutyl isocyanide
for synthesis
Synonym(s):
1,1,3,3-Tetramethylbutyl isocyanide, Thiocarbamide, 1,1,3,3,-Tetramethylbutylisonitrile, Walborsky reagent, tert-Octylisonitrile
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About This Item
Linear Formula:
(CH3)3CCH2C(CH3)2NC
CAS Number:
Molecular Weight:
139.24
UNSPSC Code:
12352117
EC Index Number:
238-577-8
NACRES:
NA.22
MDL number:
Assay:
≥96.0% (GC)
Form:
liquid
Quality Segment
assay
≥96.0% (GC)
form
liquid
bp
55-56 °C/15 hPa
transition temp
flash point 51 °C
density
0.80 g/cm3 at 20 °C
storage temp.
2-30°C
SMILES string
[N+](#[C-])C(CC(C)(C)C)(C)C
InChI
1S/C9H17N/c1-8(2,3)7-9(4,5)10-6/h7H2,1-5H3
InChI key
YVPXQMYCTGCWBE-UHFFFAOYSA-N
Analysis Note
Assay (GC, area%): ≥ 96.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.799 - 0.801
Identity (IR): passes test
Density (d 20 °C/ 4 °C): 0.799 - 0.801
Identity (IR): passes test
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signalword
Warning
hcodes
Hazard Classifications
Flam. Liq. 3
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
125.6 °F - closed cup
flash_point_c
52 °C - closed cup
Certificates of Analysis (COA)
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