API Process Intermediates & Related Compounds

Isocyanoacetic Acid

Name: Isocyanoacetic Acid
Brand: Zemixal
SKU: ZX-043451

Available on request

Isocyanoacetic Acid (CAS 71804-44-9) supplier Zemixal: C3H3NO2, COA and SDS with every lot, worldwide shipping. Packs from 10 mg.

Pack sizes

CAS number71804-44-9

FormulaC₃H₃NO₂

Molar mass85.06 g/mol

Physical formSolid

InChIKeyCFCNTIFLYGKEIO-UHFFFAOYSA-N

IUPAC name2-isocyanoacetic acid

About Isocyanoacetic Acid

Researchers and plant chemists source Isocyanoacetic Acid from Zemixal for routine and specialised work. Identity at a glance: CAS 71804-44-9, formula C3H3NO2 and molar mass 85.06 g/mol. It is handled as a solid.

Use cases we see most often

API route development
Impurity fate & purge studies
Analytical method development
Fine chemical synthesis

Storage and safety notes

Handle with the usual laboratory precautions and consult the SDS supplied with each lot.

Available as 10 mg, 25 mg, 50 mg and 100 mg. Larger or split packs can be arranged. 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.

Reference standards for Ascorbic acid

See every impurity, metabolite and related compound we list for this API.

Ascorbic acid standards

Typical uses

API route development
Impurity fate & purge studies
Analytical method development
Fine chemical synthesis

Applications

Pharmaceutical Manufacturing and QC Research Labs and Universities

Specifications and identifiers

Specifications of Isocyanoacetic Acid
Product name	Isocyanoacetic Acid
Catalogue number	ZX-043451
CAS number	71804-44-9
IUPAC name	2-isocyanoacetic acid
Molecular formula	C₃H₃NO₂
Molar mass	85.06 g/mol
Exact mass	85.0164
Physical form	Solid
XLogP3	-0.8
H-bond donors / acceptors	1 / 3
Topological polar surface area	41.7 Å²
InChIKey	CFCNTIFLYGKEIO-UHFFFAOYSA-N
SMILES	[C-]#[N+]CC(=O)O
PubChem CID	15430234

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

Safety and GHS hazards

No GHS classification is on file for this item. Handle it as an unknown laboratory chemical and request the SDS with your quotation.

Pack sizes

Pack sizes of Isocyanoacetic Acid
10 mg	Quoted on request
25 mg	Quoted on request
50 mg	Quoted on request
100 mg	Quoted on request

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

Questions about Isocyanoacetic Acid

Which CAS number identifies Isocyanoacetic Acid?

Isocyanoacetic Acid is registered under CAS 71804-44-9. Our catalogue number for this item is ZX-043451.

What are the formula and molar mass of Isocyanoacetic Acid?

For Isocyanoacetic Acid, its formula is C3H3NO2 and its molar mass is 85.06 g/mol. The systematic (IUPAC) name is 2-isocyanoacetic acid. InChIKey CFCNTIFLYGKEIO-UHFFFAOYSA-N lets you match it in any structure database.

How is Isocyanoacetic Acid used in pharmaceutical QC?

Isocyanoacetic Acid is a characterised reference material linked to Ascorbic acid. Laboratories use it to identify and quantify this impurity during method development and validation, stability work, batch release testing and regulatory submissions.

What grade and pack sizes are available for Isocyanoacetic Acid?

The grade and assay are confirmed on the quotation and the batch COA. Standard packs are 10 mg, 25 mg, 50 mg, 100 mg. Larger quantities and custom packing can be quoted on request.

Which documents come with Isocyanoacetic Acid?

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 Isocyanoacetic Acid to my country?

Yes. Isocyanoacetic Acid ships worldwide by express courier, air cargo or sea freight, quoted on the Incoterm you prefer, with full export documents.

More Ascorbic acid standards

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