| Identification | Back Directory | [Name]
TERT-OCTYL ISOCYANATE | [CAS]
1611-57-0 | [Synonyms]
TERT-OCTYL ISOCYANATE
1,1,3,3-TETRAMETHYLBUTYL ISOCYANATE
2,4,4-trimethyl-2-pentyl isocyanate
2-isocyanato-2,4,4-trimethylpentane
1,1,3,3-Tetramethylbutyl isocyanate 98%
1,1,3,3-Tetramethylbutyl isocyanate~2,4,4-Trimethyl-2-pentyl isocyanate | [EINECS(EC#)]
-0 | [Molecular Formula]
C9H17NO | [MDL Number]
MFCD00209615 | [MOL File]
1611-57-0.mol | [Molecular Weight]
155.24 |
| Chemical Properties | Back Directory | [Boiling point ]
170-172 °C(lit.)
| [density ]
0.859 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.426(lit.)
| [Fp ]
118 °F
| [storage temp. ]
2-8°C | [form ]
liquid | [Sensitive ]
Moisture Sensitive | [InChI]
1S/C9H17NO/c1-8(2,3)6-9(4,5)10-7-11/h6H2,1-5H3 | [InChIKey]
XOHBENIMDRFUIH-UHFFFAOYSA-N | [SMILES]
CC(C)(C)CC(C)(C)N=C=O | [CAS DataBase Reference]
1611-57-0 |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
10-20/21/22-36/37/38 | [Safety Statements ]
16-23-26-36/37/39 | [RIDADR ]
UN 3080 6.1/PG 2
| [WGK Germany ]
3
| [HazardClass ]
6.1 | [PackingGroup ]
II | [HS Code ]
2929109000 | [Storage Class]
3 - Flammable liquids | [Hazard Classifications]
Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Flam. Liq. 3
Resp. Sens. 1
Skin Irrit. 2
Skin Sens. 1
STOT SE 3 |
| Hazard Information | Back Directory | [Uses]
1,1,3,3-Tetramethylbutyl isocyanate may be used in the synthesis of amides by Grignard reaction. | [Synthesis Reference(s)]
Journal of the American Chemical Society, 78, p. 4538, 1956 DOI: 10.1021/ja01599a008 | [General Description]
1,1,3,3-Tetramethylbutyl isocyanate is a sterically hindered isocyanate. Its synthesis from tert-octylamine has been reported. |
|
| Company Name: |
Alfa Aesar
|
| Telephone: |
400-6106006 |
| Website: |
http://chemicals.thermofisher.cn |
| Company Name: |
Sigma-Aldrich
|
| Telephone: |
021-61415566 800-8193336 |
| Website: |
https://www.sigmaaldrich.cn |
|