[Di-tert-butyl(chloro)phosphine]palladium(II) Dichloride Dimer

CAS

386706-33-8

Catalog Number

ACM386706338

Category

Palladium series catalysts

Molecular Weight

715.952g/mol

Molecular Formula

C16H36Cl6P2Pd2;

MSDS COA Spec Sheet

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Specification

Synonyms

386706-33-8;Dichloro[di-tert-butyl(chloro)phosphine]palladium(II) Dimer;DTXSID20693731;D3704;[Di-tert-butyl(chloro)phosphine]palladium(II) Dichloride Dimer;DICHLORO(CHLORODI-T-BUTYLPHOSPHINE)PALLADIUM(II) DIMER;Palladium(2+) chloride--di-tert-butylphosphinous chloride (1/2/1);

IUPAC Name

ditert-butyl(chloro)phosphane;palladium(2+);tetrachloride;

Canonical SMILES

CC(C)(C)P(C(C)(C)C)Cl.CC(C)(C)P(C(C)(C)C)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2].[Pd+2];

InChI

InChI=1S/2C8H18ClP.4ClH.2Pd/c2*1-7(2,3)10(9)8(4,5)6;;;;;;/h2*1-6H3;4*1H;;/q;;;;;;2*+2/p-4;

InChI Key

NJIMMSLZDJFGSV-UHFFFAOYSA-J;

Complexity

93.4

Covalently-Bonded Unit Count

Exact Mass

715.847g/mol

H-Bond Acceptor

Heavy Atom Count

Monoisotopic Mass

711.849g/mol

Rotatable Bond Count

Topological Polar Surface Area

0A^2

What is the molecular formula of [Di-tert-butyl(chloro)phosphine]palladium(II) Dichloride Dimer?

The molecular formula is C16H36Cl6P2Pd2.

What is the molecular weight of the compound?

The molecular weight is 716.0 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is ditert-butyl(chloro)phosphane;palladium(2+);tetrachloride.

What is the InChI of the compound?

The InChI is InChI=1S/2C8H18ClP.4ClH.2Pd/c2*1-7(2,3)10(9)8(4,5)6;;;;;;/h2*1-6H3;4*1H;;/q;;;;;;2*+2/p-4.

What is the InChIKey of the compound?

The InChIKey is NJIMMSLZDJFGSV-UHFFFAOYSA-J.

What is the CAS number of the compound?

The CAS number is 386706-33-8.

How many hydrogen bond donor counts does the compound have?

The compound has 0 hydrogen bond donor count.

How many hydrogen bond acceptor counts does the compound have?

The compound has 4 hydrogen bond acceptor counts.

How many rotatable bond counts does the compound have?

The compound has 4 rotatable bond counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the molecular weight of [Di-tert-butyl(chloro)phosphine]palladium(II) Dichloride Dimer?

The molecular weight is 716.0 g/mol.

What is the InChI key of the compound?

The InChI key is NJIMMSLZDJFGSV-UHFFFAOYSA-J.

How many hydrogen bond donor counts are there in the compound?

There are 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts are there in the compound?

There are 4 hydrogen bond acceptor counts.

How many rotatable bond counts are there in the compound?

There are 4 rotatable bond counts.

What is the exact mass of the compound?

The exact mass is 715.84676 g/mol.