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fluocinonide

fluocinonide

CAS: 356-12-7

Formula: C26H32F2O7

SMILES: [H][C@@]12C[C@@]3([H])[C@]4([H])C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]1(OC(C)(C)O2)C(=O)COC(C)=O

IUPAC: 2-[(1S,2S,4R,8S,9S,11S,12R,13S,19S)-12,19-difluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosa-14,17-dien-8-yl]-2-oxoethyl acetate

InChI: InChI=1S/C26H32F2O7/c1-13(29)33-12-20(32)26-21(34-22(2,3)35-26)10-15-16-9-18(27)17-8-14(30)6-7-23(17,4)25(16,28)19(31)11-24(15,26)5/h6-8,15-16,18-19,21,31H,9-12H2,1-5H3/t15-,16-,18+,19+,21+,23+,24-,25-,26+/m1/s1

Composition: C (63.15%), H (6.52%), F (7.68%), O (22.65%)

Molar Mass: 494.532

Atom Count: 67

Heavy Atom Count: 35

Properties
Properties
Common Names bestasone; biscosal; cortalar; fluocinolide; fluocinolide acetate; fluocinolone acetonide acetate; fluocinonide; fluocinonide [usan:ban:inn:jan]; fluocinonide emulsified base; fluocinonido [inn-spanish]; fluocinonidum; fluonex; fluzon; lidex; lidex E; lidex-E; lonide; lyderm; metosyn; straderm; synalar acetate; topsymin; topsyn; vanos; 醋酸氟轻松
Aromatic Ring Count 0
Asymmetric Atom Count 9
Exact Mass 494.211609696
Formal Charge 0
FSP3 0.73
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
InChIKey WJOHZNCJWYWUJD-IUGZLZTKSA-N
Lipinski's Rule of Five 1
Molar Refractivity 120.56
Topological Polar Surface Area 99.13
Polarizability 47.01
Ring Count 5
Rotatable Bond Count 4

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