AG002QJS

25122-46-7 | Pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxopropoxy)-, (11β,16β)-

AG002QJS

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CAS Number	25122-46-7
Catalog Number	AG002QJS(AGN-PC-015I9W)
Chemical Name	Pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxopropoxy)-, (11β,16β)-
EC Number	246-634-3
IUPAC Name	[(8S,9R,10S,11S,13S,14S,16S,17R)-17-(2-chloroacetyl)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate
InChI	InChI=1S/C25H32ClFO5/c1-5-21(31)32-25(20(30)13-26)14(2)10-18-17-7-6-15-11-16(28)8-9-22(15,3)24(17,27)19(29)12-23(18,25)4/h8-9,11,14,17-19,29H,5-7,10,12-13H2,1-4H3/t14-,17-,18-,19-,22-,23-,24-,25-/m0/s1
InChI Key	CBGUOGMQLZIXBE-XGQKBEPLSA-N
MDL Number	MFCD00058499
Molecular Formula	C25H32ClFO5
Molecular Weight	466.9700
SMILES	O(C(CC)=O)[C@@]1(C(CCl)=O)[C@]2(C)[C@@](C[C@@H]1C)([C@]3([C@](F)([C@@H](O)C2)[C@]4(C)C(CC3)=CC(=O)C=C4)[H])[H]
UNII	779619577M
Synonyms	Clobetasol, Clobetasol 17 Propionate, Clobetasol 17-Propionate, Clobetasol Propionate, Clobex, Clofenazon, Cormax, Dermovate, Embeline, Embeline E, OLUX, Temovate, CLOBETASOL PROPIONATE, 25122-46-7, Clobetasol 17-propionate, Clobex, Dermovate, Temovate, Embeline, Embeline E, Clobesol, Cormax, Olux, Temovate E, Olux-E, Clobestasol propionate, clobetasol 17-propanoate, GR 2/925, C25H32ClFO5, MLS000028708, Clobetasol propionate [USAN:JAN], CCI 4725, CGP 9555, 21-Chloro-9-fluoro-11beta,17-dihydroxy-16beta-methylpregna-1,4-diene-3,20-dione 17-propionate, EINECS 246-634-3, UNII-779619577M, [(8S,9R,10S,11S,13S,14S,16S,17R)-17-(2-chloroacetyl)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate, CLOBETASOL PROPIONATE (EMOLLIENT), SMR000058745, CHEBI:31414, CCI-4725, MFCD00058499, DSSTox_CID_25907, DSSTox_RID_81219, DSSTox_GSID_45907, 21-Chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxopropoxy)pregna-1,4-diene-3,20-dione (11beta,16beta)-, Pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxopropoxy)-, (11beta,16beta)-, 779619577M, Dermoxinale, Butavate, Dermoval, Yugofin, 21-chloro-9-fluoro-11beta-hydroxy-16beta-methyl-3,20-dioxopregna-1,4-dien-17-yl propanoate, 21-Chloro-9-fluoro-11beta-hydroxy-16beta-methylpregna-1,4-diene-3,20-dione 17-propionate, Clobetasolpropionate, Olux E, 21-Chloro-9alpha-fluoro-11beta,17alpha-dihydroxy-16beta-methyl-1,4-pregnadiene-3,20-dione 17-Propionate, Pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11-beta,17-dihydroxy-16-beta-methyl-, 17-propionate, Clobetasol propionate gel, Clarelux, Impoyz, NCGC00095078-01, CPD000058745, clobetasol-propionate, CAS-25122-46-7, Cormax (TN), Clobetasole propionate, Clobetasol propionate [USAN:USP:JAN], OLUX FOAM, Clobetasol propionate E, Propionic acid clobetasol, Opera_ID_1470, Clobetasolpropionat mikron., AC1L1OG9, AC1Q3T8C, SCHEMBL3997, cid_32798, MLS001076345, AMOT0927, GTPL7062, CCl 4725, CHEMBL1159650, DTXSID6045907, BDBM39347, CGP9555, EBD6220, HMS2090A04, HMS2230H08, HMS3259A10, HMS3714M04, Clobetasol propionate (JP17/USP), BCP04125, ZINC3977767, Tox21_111414, s2584, AKOS015951278, Tox21_111414_1, BCP9000539, CCG-220781, CS-2594, DB01013, NC00551, NCGC00023373-03, NCGC00023373-04, AC-17990, AN-14318, AS-12555, CC-25914, Clobetasol propionate, analytical standard, HY-13600, BCP0726000094, AB1009262, LS-118433, D01272, AB00383081-10, AB00383081_11, 122C467, C-22667, SR-01000000280, SR-01000000280-4, BRD-K10799896-001-10-6, BRD-K10799896-001-26-2, Clobetasol propionate, European Pharmacopoeia (EP) Reference Standard, Clobetasol propionate, United States Pharmacopeia (USP) Reference Standard, 21-Chloro-9-fluoro-11b,17-dihydroxy-16b-methylpregna-1,4-diene-3,20-dione 17-propionate, Clobetasol for peak identification, European Pharmacopoeia (EP) Reference Standard, Clobetasol Propionate, Pharmaceutical Secondary Standard; Certified Reference Material, (11b,16b)-21-Chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxopropoxy)pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11 beta-hydroxy-16 beta-methylpregna-1,4-diene-3,20-dione 17-propionate, CGP9555 pound>> CCl 4725 pound>>CGP 9555 pound>> CCl4725 pound>>CGP-9555 pound>> CCl-4725, Pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11-beta,17-dihydroxy-16-beta-methyl-,17-propionate, clobetasol, Luxiq, Clofenazon, null, Clobex (TN), Olux (TN), Clobetasol 17 Propionate, C25-H32-Cl-F-O5, CID32798, ACN-036936, Clobetasol propionate, 98% - 1G 1g, CS-O-06239, B1915, C2612, D002990, 25122-41-2, Pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11,17-dihydroxy-16-methyl-, (11beta,16beta)-, Pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11-hydroxy- 16-methyl-17-(1-oxopropoxy)-, (11ss,16ss)-, Pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxopropoxy)-, (11.beta.,16.beta.)-, Pregna-1,4-dieno-3,20-diona, 21-cloro-9-fluoro-11-hidroxi-16-metil-17-(1-oxopropoxi)-, (11?,16?)-,

Complexity	929
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	8
Defined Bond Stereocenter Count	0
Exact Mass	466.192g/mol
Formal Charge	0
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	466.974g/mol
Monoisotopic Mass	466.192g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	80.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H360-H373-H410
Packing Group	Ⅲ
Precautionary statements	P201-P273-P308+P313
UN Code	UN 3077

Certificate of Analysis

Lot Number