Phosphorisocyanatidic dichloride

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Molecular Formula:

CCl2NO2P

Molecular Weight:

159.895961

CAS Number:

870-30-4

Catalog Number:

870-30-4

Product Information

Molecular Formula:

CCl2NO2P

Molecular Weight:

159.895961

Description

Phosphorisocyanatidic dichloride is an indispensable reagent in the biomedicine sector and assumes a pivotal function when it comes to synthesizing a diverse array of drugs, chiefly those employed in combating cancer and autoimmune ailments. Leveraging its extraordinary chemical attributes, this compound facilitates the precise alteration and functionalization of molecules, thereby propelling the advancement of targeted therapeutic strategies intertwined with pharmaceutical exploration.

Synonyms

PHOSPHOROISOCYANATIDIC DICHLORIDE; phosphorisocyanatidic dichloride; Isocyanatodichlorophosphine oxide; Phosphoric aciddichloride isocyanate; dichlorophosphorylimino(keto)methane; dichlorophosphorylimino(oxo)methane

IUPAC Name

dichlorophosphorylimino(oxo)methane

Canonical SMILES

C(=NP(=O)(Cl)Cl)=O

InChI

InChI=1S/CCl2NO2P/c2-7(3,6)4-1-5

InChI Key

QKPIQPBNFUNZSJ-UHFFFAOYSA-N

Flash Point

161.2 °F

Purity

95%

Density

1.623 g/mL at 25 °C

Refractive Index

n20/D 1.468

Safety Information

Hazards

H301 - H314

Precautionary Statement

P280 - P301 + P310 + P330 - P301 + P330 + P331 - P303 + P361 + P353 - P305 + P351 + P338

Computed Properties

XLogP3

2.1

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

158.9043706 g/mol

Monoisotopic Mass

158.9043706 g/mol

Topological Polar Surface Area

46.5Å²

Heavy Atom Count

Formal Charge

Complexity

144

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

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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Phosphorisocyanatidic dichloride

Product Information

Safety Information

Computed Properties

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