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Structure

(Bromomethyl)triphenylphosphonium bromide

CAS
1034-49-7
Catalog Number
ACM1034497-1
Category
Other Products
Molecular Weight
436.12
Molecular Formula
C19H17Br2P

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Specification

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
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
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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