601-57-0
中文名稱
4-膽甾烯-3-酮
英文名稱
4-Cholesten-3-one
CAS
601-57-0
EINECS 編號(hào)
210-005-1
分子式
C27H44O
MDL 編號(hào)
MFCD00003663
分子量
384.64
MOL 文件
601-57-0.mol
更新日期
2026/05/11 09:43:36
601-57-0 結(jié)構(gòu)式
基本信息
中文別名
4-膽甾烯-3-酮正-4-膽甾烯-3-酮
膽甾烯酮
膽甾-4-烯-3-酮
4-膽甾烯-3-酮, 98+%
英文別名
17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecah17-(1,5-DIMETHYLHEXYL)-10,13-DIMETHYL-2,3,6,7,8,9,10,11,12,13,14,15,16,17-TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-3-ONE
3-KETO-4-CHOLESTENE
(+)-3-OXO-4-CHOLESTENE
3-OXO-4-CHOLESTENE
(+)-4-CHOLESTEN-3-ONE
4-CHOLESTEN-3-ONE
(8S,9S,10R,13R,14S,17R)-17-((R)-1,5-DIMETHYL-HEXYL)-10,13-DIMETHYL-1,2,6,7,8,9,10,11,12,13,14,15,16,17-TETRADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-3-ONE
CHOLEST-4-ENE-3-ONE
CHOLESTENONE
3-Oxocholest-4-ene
4-Cholestenone
cholest-4-en-3-one
delta4-Cholesten-3-one
17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-one
10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
4-CHOLESTEN-3-ONE, 98+%
(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
3-Keto-4-cholestene, 3-Oxo-4-cholestene
3-Keto-4-cholestene, 3-Oxo-4-cholestene, 4-Cholesten-3-one
所屬類別
天然產(chǎn)物：甾體化合物物理化學(xué)性質(zhì)
熔點(diǎn)79-82 °C
比旋光度92.5 º (c=2, CHCl3)
沸點(diǎn)451.27°C (rough estimate)
密度0.9717 (rough estimate)
折射率1.5100 (estimate)
儲(chǔ)存條件-20°C
溶解度可溶于氯仿（少量）、甲醇（輕微加熱）
形態(tài)固體
顏色白色至灰白色
旋光度 (Optical Rotation)[α]23/D +91.0°, c = 2 in chloroform
水溶解性<0.5 g/L
BRN4707774
穩(wěn)定性穩(wěn)定的。與強(qiáng)氧化劑不相容。
InChI1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h17-19,22-25H,6-16H2,1-5H3/t19-,22+,23-,24+,25+,26+,27-/m1/s1
InChIKeyNYOXRYYXRWJDKP-GYKMGIIDSA-N
SMILES[H][C@@]12[C@]([C@](CC3)(C)C(CC2)=CC3=O)([H])CC[C@@]4(C)[C@@]1([H])CC[C@]4([H])[C@]([H])(C)CCCC(C)C
CAS 數(shù)據(jù)庫601-57-0(CAS DataBase Reference)
NIST化學(xué)物質(zhì)信息Cholest-4-en-3-one(601-57-0)
EPA化學(xué)物質(zhì)信息Cholest-4-en-3-one (601-57-0)
安全數(shù)據(jù)
危險(xiǎn)性描述H413
危險(xiǎn)品標(biāo)志Xi
危險(xiǎn)類別碼36/37/38
安全說明S22-S24/25
WGK Germany3
RTECS號(hào)FZ7700000
TSCAYes
海關(guān)編碼29142900
存儲(chǔ)類別11 - Combustible Solids