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(3-Benzyloxypropyl)triphenylphosphonium bromide - 97%, high purity , CAS No.54314-85-1

COA

Grade & Purity:

≥97%

Cas Number: 54314-85-1
Molecular Weight: 491.4
PubChem CID: 10929077
PubChem SID: 488196939

In stock

Item Number

B341757

Grouped product items
SKU	Size	Availability	Price
B341757-250mg	250mg	2	$11.90
B341757-1g	1g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$36.90
B341757-5g	5g	2	$141.90

Discover (3-Benzyloxypropyl)triphenylphosphonium bromide by Aladdin Scientific in 97% for only $11.90. Available - in Ligands at Aladdin Scientific. a useful wittig reagent to create antitumor compounds Tags: .

Basic Description

Synonyms	MFCD00191781 \| triphenyl(3-phenylmethoxypropyl)phosphanium;bromide \| [3-(Benzyloxy)propyl]triphenylphosphoniumBromide \| DWYCJWXMZGVGJV-UHFFFAOYSA-M \| SY024113 \| 3-Benzyloxypropyltriphenylphosphonium Bromide \| DTXSID90448639 \| AKOS015913243 \| (3-(benzyloxy
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Phenylphosphines and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Phenylphosphines and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Phenylphosphines and derivatives
Alternative Parents	Benzylethers Dialkyl ethers Organophosphorus compounds Organic bromide salts Hydrocarbon derivatives Organic cations
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Triphenylphosphine - Benzylether - Phenylphosphine - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organic bromide salt - Organic salt - Organophosphorus compound - Organooxygen compound - Organic cation - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylphosphines and derivatives. These are compounds containing a phenylphosphine, which consists of phosphine substituent bound to a phenyl group.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488196939
IUPAC Name	triphenyl(3-phenylmethoxypropyl)phosphanium;bromide
INCHI	InChI=1S/C28H28OP.BrH/c1-5-14-25(15-6-1)24-29-22-13-23-30(26-16-7-2-8-17-26,27-18-9-3-10-19-27)28-20-11-4-12-21-28;/h1-12,14-21H,13,22-24H2;1H/q+1;/p-1
InChIKey	DWYCJWXMZGVGJV-UHFFFAOYSA-M
Smiles	C1=CC=C(C=C1)COCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]
Isomeric SMILES	C1=CC=C(C=C1)COCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]
WGK Germany	3
Molecular Weight	491.4
Reaxy-Rn	4633984
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4633984&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

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Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
F2204124	Certificate of Analysis	Mar 03, 2025	B341757
F2204125	Certificate of Analysis	Mar 03, 2025	B341757
F2204126	Certificate of Analysis	Mar 03, 2025	B341757

Chemical and Physical Properties

Solubility	Soluble in methanol (10 mg/ml).
Melt Point(°C)	153-154° C (lit.)
Molecular Weight	491.400 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	9
Exact Mass	490.106 Da
Monoisotopic Mass	490.106 Da
Topological Polar Surface Area	9.200 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	408.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	2

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