3-(Phenylamino)Cyclohex-2-Enone 3-苯胺基-2-环己烯-1-酮

CAS 24706-50-1 MFCD00082654

化学结构图

24706-50-1
SMILES: O=C1CCCC(=C1)NC1C=CC=CC=1

化学属性

Mol. FormulaC12H13NO
Mol. Weight187.26
Melting Point176-178
TSCANo

别名和识别编码

Chemical Name3-(Phenylamino)Cyclohex-2-Enone
Synonym 3-(Phenylamino)cyclohex-2-ene-1-one 3-((phenyl)amino)cyclohex-2-en-1-one 3-Anilinocyclohex-2-en-1-one 3-(N-phenylamino)-2-cyclohexene-1-one 3-(Phenylamino)-2-cyclohexen-1-one 3-Phenylaminocyclohexen-2-one 3-Anilino-2-cyclohexen-1-one 3-Phenylamino-cyclohex-2-enone
MDL NumberMFCD00082654
CAS Number24706-50-1
Beilstein Registry Number2103381
Chemical Name Translation3-苯胺基-2-环己烯-1-酮
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; alicycle; 6RingOnly; 6ring; ketone; 1fragment

相关文献及参考

  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.

安全信息

RTECSGW7600000
GHS Symbol
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
Precautionary statements
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 600 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JKXXAF Japanese Kokai Tokyo Koho Patents.  (U.S. Patent and Trademark
   Office, Foreign Patents, Washington, DC 20231)  Volume(issue)/page/year:
   #92-282314

系列性分类

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