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Pentyl isocyanate

CAS 3954-13-0C6H11NOMW 113.16

Pentyl isocyanate (CAS registry number 3954-13-0) is supplied as a chemical raw material for formulation and synthesis work. The molecular formula is C6H11NO, giving a molecular weight of 113.16 g/mol. This is a organic compound of 6 carbon with 2 heteroatoms, predominantly aliphatic; of low molecular weight. Documents are issued per shipment rather than per catalogue entry: each batch is accompanied by a Certificate of Analysis, and safety data sheets, technical datasheets and third-party test reports are supplied on request for export documentation.

Product Overview

CAS Number3954-13-0
Molecular FormulaC6H11NO
Molecular Weight113.16
LogP2.8
Purityper batch COA (not published)
Packagingper order / batch confirmation (not published)
ApplicationsOrganic Chemicals
CategoryOrganic Chemicals

Applications

Organic Chemicals

Recorded applications for this entry: Organic Chemicals. Where your formulation differs, the relevant point to check is not the use category but the impurity profile — tell us the end use and we will map it to the specification.

For export enquiries, include the destination country and the intended application in your message. This lets us confirm whether the grade needs any additional documentation beyond the standard per-batch COA, and whether the packing suits the planned transport mode.

Packaging & Storage

Packagingper order / batch confirmation (not published)
Purityper batch COA (not published)
StorageSealed, cool and dry place
ShippingStandard chemical transport
SampleAvailable on request
Lead TimeIn stock / per order

Packing is per order / batch confirmation (not published) and purity is per batch COA (not published). Both are agreed at order stage; for export movements the packing is chosen with the transport mode and destination in mind, and drum, bag or repacked formats are all available. Storage: sealed, in a cool and dry place, away from direct sunlight.

Each shipment is accompanied by a batch Certificate of Analysis. For cross-border orders, MSDS, technical datasheets and third-party test reports can be issued to match your documentation set; declare the destination country when you enquire so the paperwork matches on arrival. Contact: info@591daili.com · +86-18553102138.

Quality & Documentation

COA (Certificate of Analysis) is provided with every batch. MSDS/technical data sheets and third-party test reports are available on request. Purity and packaging are subject to batch COA and order confirmation.

Molecular Character — Selection Notes

What the structure means for your process

From a process-selection standpoint, This product is an aliphatic organic carrying 1 oxygen, 1 nitrogen, and leans lipophilic, preferring the organic phase. defines where this material fits and where it does not. Three points deserve checking before purchase: structural type, which sets the reactive sites and compatibility; polarity class, which dictates the solvent system; and molecular-weight range, which governs dosage and dispersion feasibility.

For this product specifically: the saturated aliphatic backbone is stable at ambient conditions, so oxidation risk comes mainly from oxygen, peroxides or trace transition metals introduced in processing rather than from the skeleton itself. If oxidisable components are also present, evaluate the order of addition during storage.

How it behaves in your formulation

Lipophilic character means it prefers the oil phase. In a predominantly aqueous formulation it will form discrete droplets and reduce stability, so emulsification or pre-dissolution in a compatible solvent is normally required. Confirm this at trial stage — creaming in the finished product is far harder to trace back.

Below 120 g/mol this is a small molecule — diffusing quickly, soluble or volatile. It penetrates substrates and interfaces, which suits it as a solvent, additive, fragrance base or intermediate. For procurement that means you may not need to hold large tonnage; frequent smaller buys are often cheaper.

Storage, handling and documents

A few points on receipt and storage. pre-dissolve lipophilic material in a compatible solvent before introducing it to the aqueous phase; specific handling and PPE follow the MSDS issued with the batch.. For inbound or outbound shipments, confirm packing group and transport classification in advance to avoid demurrage caused by documentation mismatch.

On documentation: the batch COA travels with every shipment; MSDS, technical datasheets and third-party test reports can be issued on request. If your quality system requires supplier qualification documents — business licence, production permit, management-system certificates — state the destination country and the document list when you enquire, and we will assemble the set at once.

Technical Profile

What this product is

Pentyl isocyanate is a carbon-based organic compound with CAS registry number 3954-13-0 and molecular formula C6H11NO (molecular weight 113.16), belonging to the organic chemicals segment of chemical raw materials.

This entry belongs to the organic chemicals range, where the material is normally supplied against a stated grade rather than blended to a formula. Where a buyer works to a published standard, the useful conversation is about which data the grade is qualified against and how deviations are handled, rather than about the use category itself.

Jinan Shenghe Chemical Co., Ltd. supplies Pentyl isocyanate with stable inventory and provides a Certificate of Analysis (COA) with each batch; custom repacking is available per process requirement.

Identification

CAS number: 3954-13-0 — searchable in PubChem for physicochemical, safety and regulatory data.

Its molecular formula C6H11NO comprises 6 C, 11 H, 1 N, 1 O atoms.

Also known as: Pentyl isocyanate · 异氰酸戊酯

Category: organic chemicals

Applications and qualification

Within the organic chemicals segment, the technical questions differ from other categories. Buyers here are usually working to a specification or a standard rather than to a general description, so the useful conversation covers impurity profile, particle size or assay method, and which data the grade is qualified against.

For qualification work, we can supply a sample batch with full documentation so that incoming QC has something concrete to compare against. Mentioning the destination country at enquiry stage also lets us match the paperwork set to your import requirements.

Specification and documentation

Purity available is per batch COA (not published), with packing per order / batch confirmation (not published). Neither value is asserted in advance: every batch ships with a Certificate of Analysis carrying the measured results, so incoming QC compares against real data rather than a catalogue claim. MSDS, technical datasheets and third-party test reports can be issued for qualification purposes — state the standard you qualify against when you enquire.

Sourcing and supply

Supplier: Jinan Shenghe Chemical Co., Ltd.. For export orders, state the destination country, the transport mode and the document set you need when you enquire — packing, paperwork and quotation terms all follow from those three. Samples can be arranged for qualification, and lead time depends on stock and order size rather than on a fixed promise.

Email: info@591daili.com · Tel/WhatsApp: +86-18553102138

Frequently Asked Questions

What is the CAS number of Pentyl isocyanate?

The CAS number of Pentyl isocyanate is 3954-13-0.

What purity and packaging are available?

Typical purity is per batch COA (not published), supplied in per order / batch confirmation (not published), with COA provided.

What are the applications of Pentyl isocyanate?

Main applications include Organic Chemicals.

What quality documents are provided?

Each batch ships with a Certificate of Analysis (COA). MSDS and other technical documents are available on request.

How should Pentyl isocyanate be stored and handled?

Store sealed in a cool, dry place. Handling and PPE follow the MSDS supplied with the batch; general chemical-handling precautions are recommended.

Can I request a sample?

Samples are available on request. Please contact us at info@591daili.com or via WhatsApp for details.

How do I buy Pentyl isocyanate or get a quote?

Email info@591daili.com or reach us on WhatsApp with the product name, CAS number and required quantity; quotes within one business day. Supplier: Jinan Shenghe Chemical Co., Ltd..

PubChem Public Data

Independent reference data for Pentyl isocyanate (CAS 3954-13-0), compiled from public chemistry databases. It is reproduced here so that a qualification decision does not depend on a single source: if your incoming specification and these values disagree, the difference is usually a measurement basis rather than an error. We would rather you saw the same reference figures we do. Values that vary by batch — assay, moisture, particle size, packaging, shelf life — are deliberately excluded and issued on the batch COA instead.

Registry identifiers across databases

CAS 号3954-13-0
PubChem CID206036
分子式C6H11NO
IUPAC 名称1-isocyanatopentane

Computed descriptors

Molecular Weight113.16
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass113.084063974
Monoisotopic Mass113.084063974
Topological Polar Surface Area29.4
Heavy Atom Count8

Synonyms and trade names

3954-13-0; 1-isocyanatopentane; Pentane, 1-isocyanato-; n-Pentyl isocyanate; DTXSID10192662; RefChem:859892; DTXCID50115153; 626-033-6; Pentyl isocyanate; 1-Pentyl isocyanate; MFCD00144846; 1-isocyanato-pentane; pentylisocyanate; Amylisocyanat; n-pentylisocyanate; n-amyl isocyanate

GHS hazard classification

已通报的危害声明H226 (100%), H302 (97.7%), H312 (90.9%), H315 (100%), H318 (90.9%), H332 (90.9%), H334 (13.6%), H335 (100%)

What the public record says

异氰酸戊酯 · CAS 3954-13-0 · C6H11NO.

Cross-database discrepancies to expect

异氰酸戊酯 的 CAS 号和分子式是什么?

CAS 号 3954-13-0;分子式 C6H11NO;分子量 — g/mol。

Source: public chemistry databases (PubChem / Wikidata) and the cited literature. Batch-dependent values are issued on the accompanying COA.

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Supplier: Jinan Shenghe Chemical Co., Ltd.

中文页面: 异氰酸戊酯

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