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Product No: AW3487

Heptyltriphenylphosphonium Bromide, >98.0%(T)(HPLC)

Name: Heptyltriphenylphosphonium Bromide
Brand: Chempure

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CAS Number

13423-48-8

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About this item

IUPAC name	heptyl(triphenyl)phosphanium;bromide
canonical smiles	CCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
inchi	InChI=1S/C25H30P.BrH/c1-2-3-4-5-15-22-26(23-16-9-6-10-17-23,24-18-11-7-12-19-24)25-20-13-8-14-21-25;/h6-14,16-21H,2-5,15,22H2,1H3;1H/q+1;/p-1
inchi key	WCZSOHSGMBVYFW-UHFFFAOYSA-M
molecular formula	C25H30BrP
synonyms	Heptyltriphenylphosphonium bromide 13423-48-8 (1-Heptyl)triphenylphosphonium bromide n-Heptyltriphenylphosphonium bromide heptyltriphenylphosphanium bromide

Computed Properties

Molecular Weight:	441.4 g/mol
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	1
Rotatable Bond Count:	9
Exact Mass:	440.12685 g/mol
Monoisotopic Mass:	440.12685 g/mol
Topological Polar Surface Area:	0 Å²
Heavy Atom Count:	27
Formal Charge:	0
Complexity:	313
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	2
Compound Is Canonicalized:	Yes

Related Compounds

Triphenylphosphine

Methyltriphenylphosphonium bromide

Butyltriphenylphosphonium bromide

Tetraphenylphosphonium bromide

Ethyltriphenylphosphonium bromide

Triphenylphosphine sulfide

Allyltriphenylphosphonium bromide

Ethyltriphenylphosphonium iodide

Triphenylmethylphosphonium

Dodecyltriphenylphosphonium bromide

Triphenyl(propyl)phosphonium bromide

Dicyclohexylphenylphosphine

Bromo(methyl)triphenylphosphorane

Hexyltriphenylphosphonium bromide

Vinyltriphenylphosphonium bromide

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (100%) Eye Irrit. 2 (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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About this item

Documentation

Certificate of Analysis

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CAS #

*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

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About this item

IUPAC name	heptyl(triphenyl)phosphanium;bromide
canonical smiles	CCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
inchi	InChI=1S/C25H30P.BrH/c1-2-3-4-5-15-22-26(23-16-9-6-10-17-23,24-18-11-7-12-19-24)25-20-13-8-14-21-25;/h6-14,16-21H,2-5,15,22H2,1H3;1H/q+1;/p-1
inchi key	WCZSOHSGMBVYFW-UHFFFAOYSA-M
molecular formula	C25H30BrP
synonyms	Heptyltriphenylphosphonium bromide 13423-48-8 (1-Heptyl)triphenylphosphonium bromide n-Heptyltriphenylphosphonium bromide heptyltriphenylphosphanium bromide

Computed Properties

Molecular Weight:	441.4 g/mol
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	1
Rotatable Bond Count:	9
Exact Mass:	440.12685 g/mol
Monoisotopic Mass:	440.12685 g/mol
Topological Polar Surface Area:	0 Å²
Heavy Atom Count:	27
Formal Charge:	0
Complexity:	313
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	2
Compound Is Canonicalized:	Yes

Related Compounds

Triphenylphosphine

Methyltriphenylphosphonium bromide

Butyltriphenylphosphonium bromide

Tetraphenylphosphonium bromide

Ethyltriphenylphosphonium bromide

Triphenylphosphine sulfide

Allyltriphenylphosphonium bromide

Ethyltriphenylphosphonium iodide

Triphenylmethylphosphonium

Dodecyltriphenylphosphonium bromide

Triphenyl(propyl)phosphonium bromide

Dicyclohexylphenylphosphine

Bromo(methyl)triphenylphosphorane

Hexyltriphenylphosphonium bromide

Vinyltriphenylphosphonium bromide

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (100%) Eye Irrit. 2 (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Product No: AW3487

Heptyltriphenylphosphonium Bromide, >98.0%(T)(HPLC)

Product No: AW3487

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

Require a Sample Certificate of Analysis (COA) ?

Reviews

Product No: AW3487

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?