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Other Organic Building Blocks

tert-Butyl isocyanate, extra pure >97%

Extra PureAvailable on request

Buy tert-Butyl isocyanate, extra pure >97% (CAS 1609-86-5) from Zemixal: C5H9NO, COA and SDS with every lot, worldwide shipping.

Pack sizes
tert-Butyl isocyanate, extra pure >97% chemical structure
CAS number1609-86-5
FormulaC5H9NO
Molar mass99.13 g/mol
Purity>97%
InChIKeyMGOLNIXAPIAKFM-UHFFFAOYSA-N
IUPAC name2-isocyanato-2-methylpropane

About tert-Butyl isocyanate, extra pure >97%

tert-Butyl isocyanate, extra pure >97% sits in our other Organic Building Blocks section and ships worldwide from stock or short lead time. Key data (Extra Pure): CAS 1609-86-5, formula C5H9NO and molar mass 99.13 g/mol.

Where it is used

  • Organic synthesis
  • API synthesis

Safe handling

It carries the GHS signal word Danger (H225, H301, H302 and H314), so wear gloves and eye protection and work with good ventilation.

Order it in 5 g, 25 g and 100 g packs or ask for a bulk quotation. Each lot travels with a batch certificate of analysis and a 16-section SDS. Send an enquiry through the quote panel and you get a formal offer with Incoterms and delivery time.

Typical uses

  • Organic synthesis
  • API synthesis

Applications

Grade guides

Specifications and identifiers

Specifications of tert-Butyl isocyanate, extra pure >97%
Product nametert-Butyl isocyanate, extra pure >97%
Catalogue numberZX-018993
CAS number1609-86-5
IUPAC name2-isocyanato-2-methylpropane
Molecular formulaC5H9NO
Molar mass99.13 g/mol
Exact mass99.0684
GradeExtra Pure
Purity / assay>97%
XLogP32
H-bond donors / acceptors0 / 2
Topological polar surface area29.4 Ų
InChIKeyMGOLNIXAPIAKFM-UHFFFAOYSA-N
SMILESCC(C)(C)N=C=O
PubChem CID62412
SynonymsPropane, 2-isocyanato-2-methyl-, t-butylisocyanate, 1,1-Dimethylethyl isocyanate, Isocyanic acid, tert-butyl ester, 2-isocyanato-2-methyl-propane, Isocyanic Acid tert-Butyl Ester, Butyl isocyanate, Tert-, t-butyl-isocynate, t-butyl-isocyanate

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

GHS02 Flammable
Flammable
GHS05 Corrosive
Corrosive
GHS06 Acute toxicity
Acute toxicity
GHS07 Irritant or harmful
Irritant or harmful
GHS08 Health hazard
Health hazard

Signal word Danger

  • H225Highly flammable liquid and vapor
  • H301Toxic if swallowed
  • H302Harmful if swallowed
  • H314Causes severe skin burns and eye damage
  • H317May cause an allergic skin reaction
  • H318Causes serious eye damage
  • H330Fatal if inhaled
  • H334May cause allergy or asthma symptoms or breathing difficulties if inhaled
  • H335May cause respiratory irritation
  • H412Harmful to aquatic life with long lasting effects

Precautionary statements P210, P233, P240, P241, P242, P243, P260, P261, P264, P264 + P265, P270, P271, P272, P273, P280, P284, P301 + P316, P301 + P317, P301 + P330 + P331, P302 + P352, P302 + P361 + P354, P303 + P361 + P353, P304 + P340, P305 + P354 + P338

Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.

Pack sizes

Pack sizes of tert-Butyl isocyanate, extra pure >97%
5 gQuoted on request
25 gQuoted on request
100 gQuoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about tert-Butyl isocyanate, extra pure >97%

Which CAS number identifies tert-Butyl isocyanate, extra pure >97%?
tert-Butyl isocyanate, extra pure >97% is registered under CAS 1609-86-5. You may also see it listed as Propane, 2-isocyanato-2-methyl-, t-butylisocyanate, 1,1-Dimethylethyl isocyanate. Our catalogue number for this item is ZX-018993.
What are the formula and molar mass of tert-Butyl isocyanate, extra pure >97%?
For tert-Butyl isocyanate, extra pure >97%, its formula is C5H9NO and its molar mass is 99.13 g/mol. The systematic (IUPAC) name is 2-isocyanato-2-methylpropane. InChIKey MGOLNIXAPIAKFM-UHFFFAOYSA-N lets you match it in any structure database.
What grade and pack sizes are available for tert-Butyl isocyanate, extra pure >97%?
This listing is Extra Pure grade with >97% purity. Standard packs are 5 g, 25 g, 100 g. Larger quantities and custom packing can be quoted on request.
Which documents come with tert-Butyl isocyanate, extra pure >97%?
Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.
Can Zemixal ship tert-Butyl isocyanate, extra pure >97% to my country?
Yes. Because tert-Butyl isocyanate, extra pure >97% is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.

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