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Butyltriphenylphosphonium chloride - 98%, high purity , CAS No.13371-17-0

COA

Grade & Purity:

≥98%

Cas Number: 13371-17-0
Molecular Weight: 354.85
EC Number: 236-443-3
MDL number: MFCD00040546
PubChem CID: 166797

In stock

Item Number

B102913

Grouped product items
SKU	Size	Availability	Price
B102913-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$42.90
B102913-100g	100g	2	$117.90
B102913-500g	500g	1	$530.90

View related series

Element classified compounds (2014) Phosphorus compounds (460)

Basic Description

Synonyms	butyl(triphenyl)phosphanium chloride \| D89162 \| Phosphonium, butyltriphenyl-, chloride \| triphenylbutylphosphonium chloride \| EINECS 236-443-3 \| MFIUDWFSVDFDDY-UHFFFAOYSA-M \| Butyltriphenylphosphonium chloride \| butyl(triphenyl)phosphanium;chloride \| FT-0
Specifications & Purity	≥98%
Storage Temp	Argon charged
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	Organopnictogen compounds Organophosphorus compounds Organic chloride salts Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Triphenylphosphine - Phenylphosphine - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organophosphorus compound - 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

IUPAC Name	butyl(triphenyl)phosphanium;chloride
INCHI	InChI=1S/C22H24P.ClH/c1-2-3-19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18H,2-3,19H2,1H3;1H/q+1;/p-1
InChIKey	MFIUDWFSVDFDDY-UHFFFAOYSA-M
Smiles	CCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]
Isomeric SMILES	CCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]
WGK Germany	3
UN Number	3464
Packing Group	III
Molecular Weight	354.85
Reaxy-Rn	4625901
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4625901&ln=

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

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot Number	Certificate Type	Date	Item
A2219256	Certificate of Analysis	Oct 16, 2023	B102913
A2219227	Certificate of Analysis	Oct 16, 2023	B102913
A2219269	Certificate of Analysis	Dec 28, 2021	B102913
E2528177	Certificate of Analysis	Dec 28, 2021	B102913
E2304496	Certificate of Analysis	Dec 28, 2021	B102913

Chemical and Physical Properties

Solubility	Soluble in Methanol
Sensitivity	Hygroscopic
Melt Point(°C)	226-230°C
Molecular Weight	354.800 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	6
Exact Mass	354.13 Da
Monoisotopic Mass	354.13 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	273.000
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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