1,1,3,3-Tetramethylbutyl isocyanide

Basic Information

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CAS Number

14542-93-9

Molecular Formula

C9H17N

Molecular Weight

139.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Boiling Point

50°C/12mmHg

Refractive Index

n20/D 1.422(lit.)

SMILES

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CC(C)(C)CC(C)(C)[N+]#[C-]

InChI

InChI=1S/C9H17N/c1-8(2,3)7-9(4,5)10-6/h7H2,1-5H3

InChIKey

YVPXQMYCTGCWBE-UHFFFAOYSA-N

LogP

2.35120

Complexity

151

Safety Information

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Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

Hazard Class

Class 3.2 Class 3.2

Synonyms & References

English

Butyl isocyanide, 1,1,3,3-tetramethyl-
GEO-02820
NSC-141688
Pentane, 2-isocyano-2,4,4-trimethyl-
1,1,3,3-tetramethyl-butylisonitrile
A808368
NSC 141688
DTXSID9065784
Butyl isocyanide,1,3,3-tetramethyl-
tert-Octyl isocyanide, Walborsky's reagent
(2,4,4-trimethylpentane-2-yl)-isocyanide
MFCD00000003
tert-Octylisocyanide
SY051435
EINECS 238-577-8
1,3,3-Tetramethylbutylisonitrile
1,1,3,3-tetramethylbutylisocyanide
Pentane,4,4-trimethyl-
SCHEMBL377668
AC4321
NSC141688
InChI=1/C9H17N/c1-8(2,3)7-9(4,5)10-6/h7H2,1-5H
14542-93-9
UNII-9EVN2N5TVN
W-200118
2-ISOCYANO-2,4,4-TRIMETHYLPENTANE
BS-21409
1,1,3,3-Tetramethylbutylisonitrile
T1054
FT-0606002
EN300-6512481

MDL Number

MFCD00000003

Customs Code

2926909090

FAQ

What regulatory guidelines apply to 1,1,3,3-Tetramethylbutyl isocyanide (CAS: 14542-93-9)?

1,1,3,3-Tetramethylbutyl isocyanide (CAS: 14542-93-9) is regulated by GHS under Classification: flammable liquid category 4. For manufacturing and import, it is subject to REACH regulations. FDA and EPA may also have additional requirements for its use in products and environmental releases. It is essential to comply with all local, national, and international regulations for handling and storage.

Are there alternatives to 1,1,3,3-Tetramethylbutyl isocyanide (CAS: 14542-93-9) in synthesis?

Yes, there are alternatives to 1,1,3,3-Tetramethylbutyl isocyanide (CAS: 14542-93-9). Common substitutes include 2,2,4-trimethylpentan-2-ione and 2,2,4-trimethylpentan-2-one isocyanate. These analogs provide similar functionalities and can be used in various synthetic routes depending on the specific application.

What is the market or research trend for 1,1,3,3-Tetramethylbutyl isocyanide (CAS: 14542-93-9)?

The market for 1,1,3,3-Tetramethylbutyl isocyanide (CAS: 14542-93-9) is stable with increasing demand in the pharmaceutical and polymer industries. Research trends focus on its use as a precursor in drug synthesis and as a cross-linking agent in polymer science. Environmental concerns are also driving the exploration of more sustainable alternatives.

How should waste containing 1,1,3,3-Tetramethylbutyl isocyanide (CAS: 14542-93-9) be handled?

Waste containing 1,1,3,3-Tetramethylbutyl isocyanide (CAS: 14542-93-9) should be collected in a sealed container and disposed of according to local regulations. It is recommended to incinerate waste under controlled conditions to minimize environmental impact. Professional waste disposal services should be used to ensure compliance with environmental protection laws and safety standards.