(Bromomethyl)triphenylphosphonium bromide

CAS
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Purity
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CAS
1034-49-7
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Purity
98%
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Catalog Number

ACM1034497-1

Product Name

(Bromomethyl)triphenylphosphonium bromide

Structure

Structure

CAS

1034-49-7

Category

Heterocyclic Organic Compound

Synonyms

DB-005516; AX8046473; TL8000148; (Bromomethyl)-triphenylphosphonium bromide; Phosphonium, (bromomethyl)triphenyl-, bromide; bromomethyl triphenylphosphonium bromide; KS-00000YQW; LS41363; SCHEMBL320149; NSC 193751;

IUPAC Name

bromomethyl(triphenyl)phosphanium;bromide

Molecular Weight

436.12

Molecular Formula

C19H17Br2P

Canonical SMILES

C1=CC=C(C=C1)[P+](CBr)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-];

InChI

YFTMLUSIDVFTKU-UHFFFAOYSA-M

InChI Key

InChI=1S/C19H17BrP.BrH/c20-16-21(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19;/h1-15H,16H2;1H/q+1;/p-1

Melting Point

234-236 °C(lit.)

Appearance

Solid

Complexity

253

Covalently-Bonded Unit Count

2

EC Number

213-857-2

Exact Mass

435.941g/mol

H-Bond Acceptor

1

Heavy Atom Count

22

Isomeric SMILES

C1=CC=C(C=C1)[P+](CBr)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Monoisotopic Mass

433.943g/mol

NSC Number

193751

Rotatable Bond Count

4

Topological Polar Surface Area

0A^2

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the chemical structure of (Bromomethyl)triphenylphosphonium bromide?

The chemical structure of (Bromomethyl)triphenylphosphonium bromide is [P+](CBr)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

What is the CAS number for (Bromomethyl)triphenylphosphonium bromide?

The CAS number for (Bromomethyl)triphenylphosphonium bromide is 1034-49-7.

How many heavy atoms are present in (Bromomethyl)triphenylphosphonium bromide?

There are 22 heavy atoms present in (Bromomethyl)triphenylphosphonium bromide.

What is the molecular weight of (Bromomethyl)triphenylphosphonium bromide?

The molecular weight of (Bromomethyl)triphenylphosphonium bromide is 436.1g/mol.

What is the IUPAC name for (Bromomethyl)triphenylphosphonium bromide?

The IUPAC name for (Bromomethyl)triphenylphosphonium bromide is bromomethyl(triphenyl)phosphanium;bromide.

How many computed covalently-bonded units are present in (Bromomethyl)triphenylphosphonium bromide?

There are 2 computed covalently-bonded units present in (Bromomethyl)triphenylphosphonium bromide.

What is the Canonical SMILES representation for (Bromomethyl)triphenylphosphonium bromide?

The Canonical SMILES representation for (Bromomethyl)triphenylphosphonium bromide is C1=CC=C(C=C1)[P+](CBr)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

What is the Monoisotopic Mass of (Bromomethyl)triphenylphosphonium bromide?

The Monoisotopic Mass of (Bromomethyl)triphenylphosphonium bromide is 433.94346.

What is the InChI key for (Bromomethyl)triphenylphosphonium bromide?

The InChI key for (Bromomethyl)triphenylphosphonium bromide is YFTMLUSIDVFTKU-UHFFFAOYSA-M.

What is another name for (Bromomethyl)triphenylphosphonium bromide?

Another name for (Bromomethyl)triphenylphosphonium bromide is bromomethyltriphenylphosphonium bromide.

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