2-(Methylsulfonyl)Benzoic Acid 2-甲砜基苯甲酸

CAS 33963-55-2 MFCD00216492

化学结构图

33963-55-2
SMILES: CS(=O)(=O)C1=CC=CC=C1C(O)=O

化学属性

Mol. FormulaC8H8O4S
Mol. Weight200
Melting Point136-141
TSCANo

别名和识别编码

Chemical Name2-(Methylsulfonyl)Benzoic Acid
CAS Number33963-55-2
Alfabeta NameMETHYLSULFONYLBENZENECARBOXYLICACID 2()-
MDL NumberMFCD00216492
Synonym 2-(Methanesulfonyl)benzoic acid 2-(Methylsulfonyl)benzoic acid
EC Number223-765-5
Chemical Name Translation2-甲砜基苯甲酸
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分类

  • {KO} CarboxylicAcids
  • {SNA} Building Blocks, C8, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks

安全信息

Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
  • S37 Wear suitable gloves 戴适当手套；
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
GHS Symbol
Signal word Danger Warning
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • 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+P352
  • P305+P351+P338
WGK Germany3
Hazard statements
  • H318 Causes serious eye damage 严重伤害眼睛
Hazard Codes Xi

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
4
Rotatable Bonds
2
H-bond Donors
1
LogP
8.900000000000000e-001

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. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acids - Carbonyl Compounds
  6. C8 - Carboxylic Acids