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?????? ?? S

?????? ?? S
?????? ?? S ??? ???
?? ??:
152-58-9
???:
?????? ?? S
???(??):
????????S;?????
???:
CORTEXOLONE
???(??):
11-DEOXYCORTISOL;CORTODOXONE;Deoxycortisol;11-DEOXY-17-HYDROXYCORTICOSTERONE;11-DESOXYCORTISOL;11-deoxyhydrocortisone;11-desoxyhydrocortisone;17,21-DIHYDROXYPROGESTERONE;17-hydroxy-11-deoxycorticosterone;4-Pregnene-17a,21-diol-3,20-dione
CBNumber:
CB0493958
???:
C21H30O4
??? ??:
346.46
MOL ??:
152-58-9.mol

?????? ?? S ??

???
205-208 °C
?? ?
401.19°C (rough estimate)
??
1.22±0.1 g/cm3 (20 ºC 760 Torr)
???
120 ° (C=1, Dioxane)
???
9℃
?? ??
Sealed in dry,Room Temperature
???
???(?? ???, ??, ??? ??), DMSO(?? ???), ???(?? ???, ??)
?? ?? (pKa)
12+-.0.60(Predicted)
??? ??
??
??? ??
??? ??
??
???? ?????
???
44.08mg/L(37 ºC)
Merck
14,2932
?? ??
?? ?? ??
???
???
InChI
InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15-,16+,17+,19+,20+,21+/m1/s1
InChIKey
WHBHBVVOGNECLV-OBQKJFGGSA-N
SMILES
C1(=O)C=C2[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@](O)(C(=O)CO)CC3)CC2
CAS ??????
152-58-9(CAS DataBase Reference)
??
  • ?? ? ?? ??
  • ?? ? ???? ?? (GHS)
??? ?? F,T
?? ???? ?? 11-23/24/25-39/23/24/25
????? 24/25-22-45-36/37-16-7
????(UN No.) UN1230 - class 3 - PG 2 - Methanol, solution
WGK ?? 3
RTECS ?? TU5011500
HS ?? 2937.23.5050
???? ??? 11 - Combustible Solids
?? mouse,LD50,intravenous,100mg/kg (100mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04684,
????(GHS): Flame (GHS02)Skull and Crossbones (GHS06)Health Hazard (GHS08)
?? ?: Danger
??·?? ??:
?? ??·?? ?? ?? ?? ?? ?? ? ?? ?? P- ??
H225 ???? ?? ? ?? ??? ?? ?? 2 ?? P210,P233, P240, P241, P242, P243,P280, P303+ P361+P353, P370+P378,P403+P235, P501
H370 ??(??, ??? ?? ??? ?? ??? ??)? ??? ???(????? ?? ???? ??? ???? ???? ???? ????? ??? ????? ??) ?? ???? ?? - 1? ?? ?? 1 ?? P260, P264, P270, P307+P311, P321,P405, P501
??????:
P210 ?·???·??·????? ????? - ?? ???.
P260 ??·?·??·???·??·...·????? ???? ???.
P280 ????/???/???/?????? ?????.
P301+P310 ???? ?? ????(??)? ??? ????.
P311 ????(??)? ??? ????.

?????? ?? S C??? ??, ??, ??

??? ??

Crystalline Solid

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???( 285)?? ??
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