1,1'-DIPROPYLHAFNOCENE DICHLORIDE

Inquiry

Molecular Formula:

C16H22Cl2Hf 10*

Molecular Weight:

463.74

CAS Number:

85722-06-1

Catalog Number:

85722-06-1

Product Information

Molecular Formula:

C16H22Cl2Hf 10*

Molecular Weight:

463.74

Description

1,1'-Dipropylhafnocene Dichloride is a compound used in biomedicine research as a catalyst in organic reactions. Its anti-tumor activity has been studied and may be useful in drug development for cancer treatment.

Synonyms

1,1'-DIPROPYLHAFNOCENE DICHLORIDE; BIS(N-PROPYLCYCLOPENTADIENYL)HAFNIUM DICHLORIDE; BIS(PROPYLCYCLOPENTADIENYL)HAFNIUM(IV) DICHLORIDE; BIS(PROPYLCYCLOPENTADIENYL)HAFNIUM(IV) DICICHLORIDE

IUPAC Name

hafnium(4+)1-propylcyclopenta-1,3-dienedichloride

Canonical SMILES

CCCC1=CC=C[CH-]1.CCCC1=CC=C[CH-]1.[Cl-].[Cl-].[Hf+4]

InChI

InChI=1S/2C8H11.2ClH.Hf/c2*1-2-5-8-6-3-4-7-8/h2*3-4,6-7H,2,5H2,1H32*1H/q2*-1+4/p-2

InChI Key

UQWWTMGDSKPUTB-UHFFFAOYSA-L

Purity

>98.0%(T)

Appearance

White to Gray to Brown powder to crystal

Safety Information

Hazards

H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
H371:
May cause damage to organs.

Precautionary Statement

P260:
Do not breathe dust, fumes, gas, mist, vapours, spray.
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P308+P311:
If exposed or concerned:
Call a POISON CENTER or doctor/physician.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

464.05642 g/mol

Monoisotopic Mass

464.05642 g/mol

Topological Polar Surface Area

0Å²

Heavy Atom Count

Formal Charge

Complexity

138

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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Volume _(final)

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1,1'-DIPROPYLHAFNOCENE DICHLORIDE

Product Information

Safety Information

Computed Properties

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