5-Bromo-2-nitrobenzaldehyde 5-溴-2-硝基苯甲醛

CAS 20357-20-4 MFCD00456508

化学结构图

20357-20-4
SMILES: [O-][N+](=O)C1C=CC(Br)=CC=1C=O

化学属性

Mol. FormulaC7H4BrNO3
Mol. Weight230.02
Melting Point71.0 to 75.0 deg-C
Density
Boiling Point

别名和识别编码

Chemical Name5-Bromo-2-nitrobenzaldehyde
CAS Number20357-20-4
Alfabeta NameBROMONITROBENZALDEHYDE 52---
MDL NumberMFCD00456508
Synonym 2-Nitro-5-bromobenzaldehyde 5-Brom-2-nitrobenzaldehyd 5-Bromo-2-nitrobenzaldehyde 5-bromo-2-nitro-benzaldehyde 5-溴-2-硝基苯甲醛 Benzaldehyde, 5-bromo-2-nitro-
Wiswesser Line NotationWNR EE BVH
Beilstein Registry Number2443255
EC Number
Chemical Name Translation5-溴-2-硝基苯甲醛
Reaxys-RN2443255
PubChem Substance ID253660039
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分类

  • {KO} Nitros
  • {KO} Aldehydes
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; aldehyde; 1fragment
  • {SNA} Building Blocks, Chemical Synthesis, Nitro Compounds, Nitrogen Compounds, Organic Building Blocks

相关文献及参考

  • Short: III/5a Title: Structure Data of Organic Crystals: C ... C 13 Author: Schudt, E.; Weitz, G. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/5a Year: 1971 ISBN: 3-540-05177-5 ISBN: 978-3-540-05177-0 Internet Resource: DOI:10.1007/b19970 RefComment: XXI, 736 pages, and VII, 890 pages. Hardcover Abstract: Volume III/5 offers a compitation as complete as possible of the space groups and lattice con-stants of all crystals which have been studied by means of X-rays, neutron and electron diffraction.

安全信息

Warnings IRRITANT
RTECSCU4875000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 32 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#07008

GHS Symbol
WGK Germany3
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P302
  • P302+P352+P332+P313+P362+P364
  • P305 IF IN EYES: 如果进入眼睛
  • P305+P351+P338+P337+P313
Signal word Warning
Safety Statements
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Risk Statements
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
UN Number
Hazard Codes
Packing Group
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤

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
3
Rotatable Bonds
1
H-bond Donors
0
LogP
2

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Nitro Compounds 硝基化合物
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Aromatic aldehyde<including acetal,hemiacetal>

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