2-(Acetylamino)benzenecarboxamide 2-(乙酰氨基)苯甲酰胺
CAS 33809-77-7 MFCD00157809
化学结构图
SMILES: CC(=O)NC1C=CC=CC=1C(N)=O
化学属性
| Mol. Formula | C9H10N2O2 |
|---|---|
| Mol. Weight | 178.19 |
| Melting Point | 182-184° |
别名和识别编码
| Chemical Name | 2-(acetylamino)benzenecarboxamide |
|---|---|
| CAS Number | 33809-77-7 |
| Alfabeta Name | ACETYLAMINOBENZENECARBOXAMIDE 2()- |
| MDL Number | MFCD00157809 |
| Synonym | 2'-Carbamoylacetanilide 2-(Acetylamino)benzamide 2-(acetylamino)benzenecarboxamide Acetanilide, 2'-carbamoyl- o-Acetamidobenzamide |
| Beilstein Registry Number | 2210851 |
| Chemical Name Translation | 2-(乙酰氨基)苯甲酰胺 |
| PubChem Substance ID | 329790956 |
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分类
- {KO} Misc
- {SNA} Amines, Building Blocks, C9, Chemical Synthesis, Nitrogen Compounds, Organic Building Blocks
安全信息
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : >2025 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 38,847,1983
GHS Symbol
- R22 Harmful if swallowed 吞咽有害
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
2
Rotatable Bonds
2
H-bond Donors
2
LogP
-2.709000000000000e-001
