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5-Methyl-3-isoxazolyl isothiocyanate

Also known as: 3-Isothiocyanato-5-methylisoxazole, 3-Isothiocyanato-5-methyl-1,2-oxazole, Isoxazole, 3-isothiocyanato-5-methyl- (9CI), 5-methylisoxazolyl-3-isothiocyanate

5-Methyl-3-isoxazolyl isothiocyanate (CAS 321309-33-5) is a compound in the Organic Acids category listed in the Jingsj chemical database. It has the molecular formula C5H4N2OS and a molecular weight of 140.16300 g/mol. Key properties include a boiling point of 284.5ºC at 760mmHg, a density of 1.29g/cm3 and a flash point of 125.9ºC. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.

CAS No.
321309-33-5
Jingsj CID
J-1146308-4
Molecular Formula
C5H4N2OS
Molecular Weight
140.16300 g/mol
Category
Organic Acids
Last updated
8/21/2026

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Physicochemical Properties

Boiling Point284.5ºC at 760mmHg
Density1.29g/cm3
Flash Point125.9ºC
Exact Mass140.00400
PSA70.48000
LogP1.71730
Refractive Index1.614

Customs & Trade Information

HS Code2934999090
Summary2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Frequently Asked Questions

What is the CAS number of 5-Methyl-3-isoxazolyl isothiocyanate?

The CAS number of 5-Methyl-3-isoxazolyl isothiocyanate is 321309-33-5.

What are the molecular formula and molecular weight of 5-Methyl-3-isoxazolyl isothiocyanate?

5-Methyl-3-isoxazolyl isothiocyanate has molecular formula C5H4N2OS and molecular weight 140.16300 g/mol.

What are the upstream and downstream products of 5-Methyl-3-isoxazolyl isothiocyanate?

For 5-Methyl-3-isoxazolyl isothiocyanate, Upstream Products: 3-Amino-5-methylisoxazole, Thiophosgene; Downstream Products: 1-[5-(phenylamino)-1,2,4-thiadiazol-3-yl]propan-2-one.

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

Last updated:

How to cite: Jingsj. "5-Methyl-3-isoxazolyl isothiocyanate (CAS 321309-33-5)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-1146308-4 (accessed 2026-11-09).

Data for reference only; verify product details with suppliers before purchase.