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Fluticasone 17β-Carboxylic Acid Propionate - 98%, high purity , CAS No.65429-42-7

COA

Grade & Purity:

≥98%

Cas Number: 65429-42-7
Molecular Weight: 452.5
PubChem CID: 9981299
PubChem SID: 504765174

In stock

Item Number

F342129

Grouped product items
SKU	Size	Availability	Price
F342129-100mg	100mg	2	$304.90
F342129-250mg	250mg	2	$684.90
F342129-1g	1g	2	$2,462.90

an impurity formed in the synthesis of Fluticasone propionate

Basic Description

Synonyms	6.ALPHA.,9-DIFLUORO-11.BETA.-HYDROXY-16.ALPHA.-METHYL-3-OXO-17-(PROPANOYLOXY)ANDROSTA-1,4-DIENE-17.BETA.-CARBOXYLIC ACID \| SCHEMBL191745 \| (6a,11b,16a,17a)-6,9-Difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)androsta-1,4-diene-17-carboxylic acid \| (6
Specifications & Purity	≥98%
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Steroids and steroid derivatives
    - Subclass Steroid esters

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Class	Steroids and steroid derivatives
Subclass	Steroid esters
Intermediate Tree Nodes	Not available
Direct Parent	Steroid esters
Alternative Parents	Androgens and derivatives 11-beta-hydroxysteroids 3-oxo delta-1,4-steroids Halogenated steroids Delta-1,4-steroids Dicarboxylic acids and derivatives Secondary alcohols Carboxylic acid esters Cyclic alcohols and derivatives Cyclic ketones Fluorohydrins Carboxylic acids Alkyl fluorides Organic oxides Hydrocarbon derivatives Organofluorides
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	20-hydroxysteroid - Steroid ester - Androgen-skeleton - Androstane-skeleton - 9-halo-steroid - 6-halo-steroid - Halo-steroid - 3-oxo-delta-1,4-steroid - Hydroxysteroid - 3-oxosteroid - Oxosteroid - 11-beta-hydroxysteroid - 11-hydroxysteroid - Delta-1,4-steroid - Dicarboxylic acid or derivatives - Cyclic alcohol - Fluorohydrin - Ketone - Carboxylic acid ester - Secondary alcohol - Cyclic ketone - Halohydrin - Carboxylic acid derivative - Carboxylic acid - Organic oxygen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Alcohol - Organic oxide - Aliphatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as steroid esters. These are compounds containing a steroid moiety which bears a carboxylic acid ester 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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504765174
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504765174
IUPAC Name	(6S,8S,9R,10S,11S,13S,14S,16R,17R)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carboxylic acid
INCHI	InChI=1S/C24H30F2O6/c1-5-19(29)32-24(20(30)31)12(2)8-14-15-10-17(25)16-9-13(27)6-7-21(16,3)23(15,26)18(28)11-22(14,24)4/h6-7,9,12,14-15,17-18,28H,5,8,10-11H2,1-4H3,(H,30,31)/t12-,14+,15+,17+,18+,21+,22+,23+,24+/m1/s1
InChIKey	DEDYNJVITFVPOG-CQRCZTONSA-N
Smiles	CCC(=O)OC1(C(CC2C1(CC(C3(C2CC(C4=CC(=O)C=CC43C)F)F)O)C)C)C(=O)O
Isomeric SMILES	CCC(=O)O[C@@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2C[C@@H](C4=CC(=O)C=C[C@@]43C)F)F)O)C)C)C(=O)O
Molecular Weight	452.5
Reaxy-Rn	3020983
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3020983&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.

3 results found

Lot Number	Certificate Type	Date	Item
K2214630	Certificate of Analysis	Aug 01, 2022	F342129
K2214566	Certificate of Analysis	Aug 01, 2022	F342129
K2214631	Certificate of Analysis	Aug 01, 2022	F342129

Chemical and Physical Properties

Solubility	Soluble in DMSO, and methanol (sparingly).
Melt Point(°C)	208-211° C
Molecular Weight	452.500 g/mol
XLogP3	2.600
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	4
Exact Mass	452.201 Da
Monoisotopic Mass	452.201 Da
Topological Polar Surface Area	101.000 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	945.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	9
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	1

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