N-Methyl-2-phenylacetamide N-甲基-2-苯基乙酰胺

CAS 6830-82-6 MFCD00051354

化学结构图

6830-82-6
SMILES: CNC(=O)Cc1ccccc1

化学属性

Mol. FormulaC9H11NO
Mol. Weight149.19
Melting Point58 °C
Boiling Point330.3±21.0 °C at 760 mmHg
Flash Point192.1±7.0 °C

别名和识别编码

Chemical NameN-Methyl-2-phenylacetamide
CAS Number6830-82-6
Alfabeta NameMETHYLPHENYLACETAMIDE N2---
MDL NumberMFCD00051354
Synonym N-methyl-2-phenylacetamide {LY} N-methyl-2-phenylacetamide {} {LY} N-methyl-2-phenylacetamide {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {} {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} N-methyl-2-phenylacetamide {} {} {} {} {} {} {} {} {} {} {} {} {
Chemical Name TranslationN-甲基-2-苯基乙酰胺
InChIKeyRKEXPBCMGJAOLM-UHFFFAOYSA-N
LabNetwork Molecule IDLN00148041
PubChem Substance ID81274
InChIInChI=1S/C9H11NO/c1-10-9(11)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,10,11)
Canonical SMILESCNC(CC1=CC=CC=C1)=O
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; amide; 1fragment
  • {KO} Misc

相关文献及参考

  • Short: III/35B Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Fluorine-19 and Nitrogen-15 Author: Balasubramanian, M.; Gupta, R.R.; Jain, M.; Perumal, S. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35B Year: 1998 ISBN: 3-540-63275-1 ISBN: 978-3-540-63275-7 Internet Resource: DOI:10.1007/b55685 RefComment: VII, 242 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), and carbon-13 (subvol. D) 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 CO-ROM's.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

Warnings IRRITANT
Storage condition

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
1
Rotatable Bonds
2
H-bond Donors
1
LogP
1

系列性分类

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