1,1,3,3-Tetramethylbutyl isocyanate

叔辛基异氰酸酯

Also known as: tert-Octyl isocyanate, 2,4,4-trimethyl-2-pentyl isocyanate, 2-isocyanato-2,4,4-trimethylpentane, t-octyl isocyanate, MFCD00209615

1,1,3,3-Tetramethylbutyl isocyanate (CAS 1611-57-0) is a compound in the Organic Acids category listed in the Jingsj chemical database. It has the molecular formula C9H17NO and a molecular weight of 155.23700 g/mol. It is also known as tert-Octyl isocyanate, 2,4,4-trimethyl-2-pentyl isocyanate and 2-isocyanato-2,4,4-trimethylpentane. Key properties include a boiling point of 170ºC, a density of 0.859 and a flash point of 62.6ºC. It is classified under GHS with signal word Warning and hazard statements H226 — Flammable liquid and vapour, H302 — Harmful if swallowed and H312 — Harmful in contact with skin. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.

CAS No.
1611-57-0
Jingsj CID
J-27560-0
Molecular Formula
C9H17NO
Chinese Name
叔辛基异氰酸酯
Molecular Weight
155.23700 g/mol
Category
Organic Acids
Last updated
8/21/2026

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Physicochemical Properties

Boiling Point170ºC
Density0.859
Flash Point62.6ºC
Exact Mass155.13100
PSA29.43000
LogP2.53700
Refractive Index1.426

GHS Safety & Compliance

Flammable / IrritantSignal word: Warning
  • H226 — Flammable liquid and vapour
  • H302 — Harmful if swallowed
  • H312 — Harmful in contact with skin
  • H315 — Causes skin irritation
  • H319 — Causes serious eye irritation
  • H332 — Harmful if inhaled
  • H335 — May cause respiratory irritation

Customs & Trade Information

HS Code2929109000
Summary2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Frequently Asked Questions

What is the CAS number of 1,1,3,3-Tetramethylbutyl isocyanate?

The CAS number of 1,1,3,3-Tetramethylbutyl isocyanate is 1611-57-0.

What are the molecular formula and molecular weight of 1,1,3,3-Tetramethylbutyl isocyanate?

1,1,3,3-Tetramethylbutyl isocyanate has molecular formula C9H17NO and molecular weight 155.23700 g/mol.

Is 1,1,3,3-Tetramethylbutyl isocyanate hazardous?

1,1,3,3-Tetramethylbutyl isocyanate has GHS signal word Warning and hazard statements H226 — Flammable liquid and vapour; H302 — Harmful if swallowed; H312 — Harmful in contact with skin.

What are the upstream and downstream products of 1,1,3,3-Tetramethylbutyl isocyanate?

For 1,1,3,3-Tetramethylbutyl isocyanate, Upstream Products: tert-Octylamine, Carbon dioxide, Di-tert-butyl dicarbonate.

Data compiled from public chemical databases and supplier catalogs; supplier offers are provided by suppliers.

Last updated:

How to cite: Jingsj. "1,1,3,3-Tetramethylbutyl isocyanate (CAS 1611-57-0)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-27560-0 (accessed 2026-10-28).

Data for reference only; verify specifications, grades and regulatory status with suppliers before purchase.