Structure

Chloro[tri(o-tolyl)phosphine]gold(I)

CAS
83076-07-7
Catalog Number
ACM83076077
Category
Gold series of catalysts
Molecular Weight
536.789g/mol
Molecular Formula
C21H21AuClP;

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Specification

Synonyms
Chloro[tri(o-tolyl)phosphine]gold(I);83076-07-7;[Tri(2-methylphenyl)phosphine]gold(I) chloride;SCHEMBL19469303;AKOS024258176;SC10739;TRA0080652;Chloro[tri(o-tolyl)phosphine]gold(I), 95%;
IUPAC Name
chlorogold;tris(2-methylphenyl)phosphane;
Canonical SMILES
CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.Cl[Au];
InChI
InChI=1S/C21H21P.Au.ClH/c1-16-10-4-7-13-19(16)22(20-14-8-5-11-17(20)2)21-15-9-6-12-18(21)3;;/h4-15H,1-3H3;;1H/q;+1;/p-1;
InChI Key
VECXLHSTZNCQLD-UHFFFAOYSA-M;
Complexity
289
Covalently-Bonded Unit Count
2
Exact Mass
536.074g/mol
Heavy Atom Count
24
Monoisotopic Mass
536.074g/mol
Rotatable Bond Count
3
Topological Polar Surface Area
0A^2
What is the molecular formula of Chloro[tri(o-tolyl)phosphine]gold(I)?

The molecular formula is C21H21AuClP.

What is the molecular weight of Chloro[tri(o-tolyl)phosphine]gold(I)?

The molecular weight is 536.8 g/mol.

How is the IUPAC name of Chloro[tri(o-tolyl)phosphine]gold(I) computed?

The IUPAC name is computed as chlorogold;tris(2-methylphenyl)phosphane.

What is the InChIKey of Chloro[tri(o-tolyl)phosphine]gold(I)?

The InChIKey is VECXLHSTZNCQLD-UHFFFAOYSA-M.

How many hydrogen bond donor counts does Chloro[tri(o-tolyl)phosphine]gold(I) have?

It has 0 hydrogen bond donor counts.

What is the exact mass of Chloro[tri(o-tolyl)phosphine]gold(I)?

The exact mass is 536.073510 g/mol.

How many defined atom stereocenters does Chloro[tri(o-tolyl)phosphine]gold(I) have?

It has 0 defined atom stereocenters.

How many covalently-bonded unit counts does Chloro[tri(o-tolyl)phosphine]gold(I) have?

It has 2 covalently-bonded unit counts.

What is the CAS number of Chloro[tri(o-tolyl)phosphine]gold(I)?

The CAS number is 83076-07-7.

Is the compound canonicalized for Chloro[tri(o-tolyl)phosphine]gold(I)?

Yes, the compound is canonicalized.

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