1,8-Diisocyanatooctane

Inquiry

Molecular Formula:

C10H16N2O2

Molecular Weight:

196.25

CAS Number:

10124-86-4

Catalog Number:

10124-86-4

Product Information

Molecular Formula:

C10H16N2O2

Molecular Weight:

196.25

Description

1,8-Diisocyanatooctane, an imperative cross-linker nestled within the fabrication intricacies of polyurethane, emerges as an essential player in the biomedical arena. As a cornerstone within Applied Biomedical science, it harnesses control over drug release, predominantly in chronic disease therapeutics, thus bolsters the potency of medicament effectiveness.

Synonyms

Octane, 1,8-diisocyanato-; Isocyanic acid, octamethylene ester; 1,8-Octamethylene diisocyanate; 1,8-Octanediyl diisocyanate; Octamethylene diisocyanate

IUPAC Name

1,8-diisocyanatooctane

Canonical SMILES

C(CCCCN=C=O)CCCN=C=O

InChI

InChI=1S/C10H16N2O2/c13-9-11-7-5-3-1-2-4-6-8-12-10-14/h1-8H2

InChI Key

QUPKOUOXSNGVLB-UHFFFAOYSA-N

Boiling Point

126-128°C at 2 Torr

Flash Point

228.2 °CF - closed cup

Purity

95%

Density

0.99±0.1 g/cm3

Storage

Store at 2-8°C

Refractive Index

n20/D 1.455 (lit.)

Safety Information

Hazards

H302 + H312 + H332 - H315 - H319 - H335

Precautionary Statement

P280 - P301 + P312 + P330 - P302 + P352 + P312 - P304 + P340 + P312 - P305 + P351 + P338

Computed Properties

XLogP3

4.3

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

196.121177757 g/mol

Monoisotopic Mass

196.121177757 g/mol

Topological Polar Surface Area

58.9Å²

Heavy Atom Count

Formal Charge

Complexity

192

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
JP-2022040236-A	Packaging materials and products	2022-01-07
JP-3236461-U	Photosensitive resin composition for sandblasting	2021-12-21
KR-20210154780-A	Silicon-carbon composite negative elelctrode active material for lithium secondary battery with improved electrochemical properties and method of manufacturing thereof, and lithium secondary batery including the same	2021-12-02
JP-2022028891-A	Packaging materials and products	2021-11-29
JP-2022022284-A	Laminates and packaging products with them	2021-11-25
JP-2022009158-A	Laminates and packaging products with them	2021-10-14
CN-113856751-A	Catalyst, preparation method thereof and polymerization method of isocyanate	2021-08-30
CN-113801551-A	Two-component coating composition and articles made therefrom	2021-08-26
CN-113437170-A	Flexible packaging composite film for solar cell back panel film and preparation method	2021-06-13
CN-113121816-A	Method for preparing polybutyrolactam by reactive extrusion	2021-04-01

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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